Aemon Chemical Technology Co., Ltd.

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Profile: Aemon Chemical Technology Co., Ltd. is a developer and manufacturer of intermediates, APIs and fine chemicals. Our product line covers chiral compounds, heterocyclic series, boric acid & phenylboronic acid series, benzene acetylene series and biphenyl series. Some of our API products are agomelatine, amantadine hydrochloride, calcitriol, capecitabine, cefotaxime sodium, dabigatran etexilate mesylate, entecavir, iloperidone, ranolazine dihydrochloride, sitagliptin phosphate and valganciclovir hydrochloride. 4-azaindole, 7-benzyloxy-3-formylindole, 5-N-boc-amino-1H-indole, 7-bromo-1H-indole-3-carboxylic acid, 6-chloroindole, 6-chloro-2-oxindole, 4,6-dichloro-2-methylindole, 4-fluoroisatoic anhydride and 6-hydroxyindole-2-carboxylic acid.

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• Acs-Pnz-Pyrrolidyl-(boc)-Nso2nh2

IUPAC Name: (4-nitrophenyl)methyl (2S,4S)-4-acetylsulfanyl-2-[[(2-methylpropan-2-yl)oxycarbonyl-sulfamoylamino]methyl]pyrrolidine-1-carboxylate | CAS Registry Number: 491878-06-9
Synonyms: Doripenem side-chain, 4-Nitrobenzyl (2S,4S)-4-acetylthio-2-[[N-sulfamoyl-N-(tert-butoxycarbonyl)amino]methyl]pyrrolidine-1-carboxylate, MolPort-020-008-107, AKOS015895484, RL03808, AK-49160, BR-49160, FT-0652014, ST51052964, I06-1122, 1-Pyrrolidinecarboxylic acid, 4-(acetylthio)-2-[[(aminosulfonyl)[(1,1-dimethylethoxy)carbonyl]amino]methyl]-, (4-nitrophenyl)methyl ester, (2S,4S)-

Molecular Formula:	C₂₀H₂₈N₄O₉S₂	Molecular Weight:	532.587720 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	11

InChIKey: JECWBBGYVBPHIH-IRXDYDNUSA-N

• Agomelatine

IUPAC Name: N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide | CAS Registry Number: 138112-76-2
Synonyms: Valdoxan, Thymanax, Agomelatine [INN], Valdoxan (TN), Agomelatine (INN), AGO-178, AGO178, C15H17NO2, AGO 178, CID82148, PDSP1_001305, PDSP1_001784, PDSP2_001289, PDSP2_001767, LS-9830, S20098, N-(2-(7-methoxy-1-naphthyl)ethyl)acetamide, N-(2-(7-Methoxynaphth-1-yl)ethyl)acetamide, S 20098, S-20098

Molecular Formula:	C₁₅H₁₇NO₂	Molecular Weight:	243.300980 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: YJYPHIXNFHFHND-UHFFFAOYSA-N

• Amantadine Hydrochloride

IUPAC Name: adamantan-1-amine hydrochloride | CAS Registry Number: 665-66-7
Synonyms: Symmetrel, Influenol, Midantane, Mydantane, Trivaline, Amazolon, Midantan, Amantan, Viregyt, Virosol, amantadine, Amantadine hydrochloride, Symadine, Virofral, Virasol, Amantadine HCl, Adamantine hydrochloride, Symmetrel (TN), 1-Adamantanamine hydrochloride, Adamantanamine hydrochloride

Molecular Formula:	C₁₀H₁₈ClN	Molecular Weight:	187.709620 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	1

InChIKey: WOLHOYHSEKDWQH-UHFFFAOYSA-N

• Amino-(3-chloro-phenyl) acetic acid

IUPAC Name: (2R)-2-azaniumyl-2-(3-chlorophenyl)acetate | CAS Registry Number: 7292-71-9
Synonyms: ZINC04203229, CID7128390

Molecular Formula:	C₈H₈ClNO₂	Molecular Weight:	185.607620 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: MGOUENCSVMAGSE-SSDOTTSWSA-N

• Benzeneacetic acid, 3-ethoxy-4-(ethoxycarbonyl)-

IUPAC Name: 2-(3-ethoxy-4-ethoxycarbonylphenyl)acetic acid | CAS Registry Number: 99469-99-5
Synonyms: 3-Ethoxy-4-ethoxycarbonyl phenylacetic acid, 2-(3-Ethoxy-4-(ethoxycarbonyl)phenyl)acetic acid, AG-I-01773, 4-Ethoxycarbonyl-3-ethoxyphenylacetic acid, 3-Ethoxy-4-(ethoxycarbonyl)phenylacetic acid, 3-ETHOXY-4-(ETHOXYCARBONYL)BENZENEACETIC ACID, (3-Ethoxy-4-(ethoxycarbonyl)phenyl)acetic acid, [3-ethoxy-4-(ethoxycarbonyl)phenyl]acetic acid, PubChem13653, ACMC-209scr, UNII-GG6C71LIOD, SureCN391346, KSC496G2B, Repaglinide related compound B, CTK3J6320, MolPort-001-758-023, ACT00935, ANW-41017, Repaglinide related compound B [USP], AKOS015919544

Molecular Formula:	C₁₃H₁₆O₅	Molecular Weight:	252.263140 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: OTGSESBEJUHCES-UHFFFAOYSA-N

• Benzenepropanoic Acid, 2-Chloro-.Beta.-[[(1,1-Dimethylethoxy)carbonyl]amino]-

IUPAC Name: 3-(2-chlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid | CAS Registry Number: 284493-66-9
Synonyms: 3-[(tert-butoxycarbonyl)amino]-3-(2-chlorophenyl)propanoic acid, 3-Boc-amino-3-(2'-chlorophenyl)propionic acid, 3-tert-butoxycarbonylamino-3-(2-chlorophenyl)propionic acid, DL-N-Boc-Beta-(2-Chlorophenyl)-alanine, 3-tert-Butoxycarbonylamino-3-(2-chloro-phenyl)-propionic acid, 3-Boc-amino-3-(2'-chlorophenyl)propionicacid, AC1MW9L4, SureCN1147244, AC1Q1N85, CTK1A0668, MolPort-001-794-067, ANW-74470, 3-(2-chlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid, AKOS005101255, AG-E-91342, AC-19547, AK-51629, KB-33298, A5398, FT-0679889

Molecular Formula:	C₁₄H₁₈ClNO₄	Molecular Weight:	299.750020 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: JBKHFGREKMCWAU-UHFFFAOYSA-N

• Benzimidazole-2-Carboxylicacidethylester

IUPAC Name: ethyl 1H-benzimidazole-2-carboxylate | CAS Registry Number: 1865-09-4
Synonyms: ethyl 1H-benzo[d]imidazole-2-carboxylate, 1H-Benzoimidazole-2-carboxylic acid ethyl ester, Benzimidazole-2-carboxylic acid ethyl ester, ethyl 1H-benzimidazole-2-carboxylate, 1865-04-9, 2-(Ethoxycarbonyl)-1H-benzimidazole, Benzimidazole-2-carboxylicacidethylester, ETHYL 2-BENZIMIDAZOLECARBOXYLATE, ethyl 1H-1,3-benzodiazole-2-carboxylate, 1h-benzimidazole-2-carboxylic acid ethyl ester, 1H-BENZO[D]IMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER, LIBRARION L914, SureCN4296230, CTK4D9258, MolPort-000-004-252, ANW-70732, ZINC16696969, AKOS005255348, AB06986, AG-E-35701

Molecular Formula:	C₁₀H₁₀N₂O₂	Molecular Weight:	190.198600 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: NMYSVCYIPOCLEC-UHFFFAOYSA-N

• Benzoyl chloride, 4-[(4-methyl-1-piperazinyl)methyl]-, dihydrochloride

IUPAC Name: 4-[(4-methylpiperazin-1-yl)methyl]benzoyl chloride;dihydrochloride | CAS Registry Number: 106261-64-7
Synonyms: 4-(4-Methylpiperazinylmethyl)benzoyl chloride dihydrochloride, 4-((4-Methylpiperazin-1-yl)methyl)benzoyl chloride dihydrochloride, 4-[(4-methylpiperazin-1-yl)methyl]benzoyl chloride dihydrochloride, SBB067956, AKOS015909677, AK122823, KB-187142, FT-0658811, A801429, I14-3223, 4-[(4-methyl-1-piperazinyl)methyl]benzoyl chloride dihydrochloride

Molecular Formula:	C₁₃H₁₉Cl₃N₂O	Molecular Weight:	325.661760 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: DDKLQZDSVJKYLJ-UHFFFAOYSA-N

• Benzyl 3-aminopyrrolidine-1-carboxylate

IUPAC Name: benzyl 3-aminopyrrolidine-1-carboxylate;hydrochloride | CAS Registry Number: 185057-50-5
Synonyms: 3-Aminopyrrolidine-1-carboxylic acid benzyl ester hydrochloride, 1-Cbz-3-aminopyrrolidine hydrochloride, 1159822-27-1, 3-AMINO-PYRROLIDINE-1-CARBOXYLIC ACID BENZYL ESTER-HCl, (S)-3-Amino-1-N-Cbz-pyrrolidine hydrochloride, PubChem11200, ACMC-209lkp, SureCN6175666, (S)-benzyl 3-aminopyrrolidine-1-carboxylate hydrochloride, KSC915A3D, N-Cbz-3-Aminopyrrolidine HCl, 1-Cbz-3-Aminopyrrolidine HCl, CTK8B5031, MolPort-003-981-679, ACT01723, ANW-47114, AKOS015919557, AK-47387, AK-51588, BR-47387

Molecular Formula:	C₁₂H₁₇ClN₂O₂	Molecular Weight:	256.728580 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: QNQVBYGRFHOBNO-UHFFFAOYSA-N

• Bis-(3,4-Dimethyl-Phenyl)-Amine

IUPAC Name: N-(3,4-dimethylphenyl)-3,4-dimethylaniline | CAS Registry Number: 55389-75-8
Synonyms: Bis-(3,4-dimethyl-phenyl)-amine, bis(3,4-dimethylphenyl)amine, Bis-(3,4-dimethylphenyl)amine, N-(3,4-Dimethylphenyl)-3,4-dimethylaniline, AG-F-93595, ZINC01045362, PubChem13458, AC1LD9KW, G00027-Watson-Int, SureCN1155655, CTK5A3533, MolPort-002-894-235, ACT09129, ANW-48064, AKOS015842308, AM82818, RP27599, BIS(3,4-DIMETHYL-PHENYL)-AMINE, AK-43307, BR-43307

Molecular Formula:	C₁₆H₁₉N	Molecular Weight:	225.328760 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: IMQQPEKHINRTCE-UHFFFAOYSA-N

• Bis-Biphenyl-4-Yl-Amine

IUPAC Name: 4-phenyl-N-(4-phenylphenyl)aniline | CAS Registry Number: 102113-98-4
Synonyms: Bis-biphenyl-4-yl-amine, Bis(4-biphenylyl)amine, 4,4'-Iminobis(biphenyl), PubChem19855, AC1L9YRZ, Bis(4-biphenyl-yl)amine, SureCN68489, ACMC-20980a, Diphenylamine, 4,4'-diphenyl-, ACT04922, 4-phenyl-N-(4-phenylphenyl)aniline, ANW-14648, ZINC16697035, AKOS015853701, RL00105, AK-46263, BR-46263, KB-48100, AM20020098, B2429

Molecular Formula:	C₂₄H₁₉N	Molecular Weight:	321.414360 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: JAUCIDPGGHZXRP-UHFFFAOYSA-N

• Boc-Pro-NH2

IUPAC Name: tert-butyl (2S)-2-carbamoylpyrrolidine-1-carboxylate | CAS Registry Number: 35150-07-3
Synonyms: 1-Boc-L-prolinamide, boc-pro-nh2, L-1-N-Boc-prolidinamide, boc-l-proline amide, boc-l-prolinamide, boc-l-pro-nh2, n-tboc-l-prolinamide, N-Boc-L-prolinamide, N-(tert-Butoxycarbonyl)proline amide, (l)-1-n-boc-prolinamide, D-N-Boc-Prolinamide, (s)-tert-butyl 2-carbamoylpyrrolidine-1-carboxylate, n-tert-butoxycarbonyl-l-proline amide, D-BOC-Pro-NH2, n-alpha-t-butyloxycarbonyl-l-proline amide, (S)-2-(Aminocarbonyl)-1-pyrrolidinecarboxylic acid, 1,1-dimethylethyl ester, tert-butyl (2S)-2-carbamoylpyrrolidine-1-carboxylate, boc-pro-nh, zlchem 118, AmbotzBAA1199

Molecular Formula:	C₁₀H₁₈N₂O₃	Molecular Weight:	214.261520 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: PITJAAIPVBVRAO-ZETCQYMHSA-N

• Boc-Tyramine

IUPAC Name: tert-butyl N-[2-(4-hydroxyphenyl)ethyl]carbamate | CAS Registry Number: 64318-28-1
Synonyms: ZINC02563753, CID11831452, Tert-butyl N-[2-(4-hydroxyphenyl)ethyl]carbamate

Molecular Formula:	C₁₃H₁₉NO₃	Molecular Weight:	237.294860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: ILNOTKMMDBWGOK-UHFFFAOYSA-N

• Boronic acid, [4-(1-naphthalenyl)phenyl]-

IUPAC Name: (4-naphthalen-1-ylphenyl)boronic acid | CAS Registry Number: 870774-25-7
Synonyms: 4-(naphthalen-1-yl)phenylboronic acid, 4-(1-Naphthyl)phenylboronic Acid, 4-(naphthalen-1-yl)phenylboronicacid, SBB052595, AG-H-51125, 4-(Naphthalen-1-yl)phenyl boronic acid, PubChem14001, SureCN431998, KSC657O2T, 1-(4-Boronophenyl)naphthalene, CTK5F7729, 4-(1-Naphthyl)benzeneboronic Acid, 4-(1-Naphthyl) phenylboronic Acid, ACT10477, ANW-51324, AKOS015855882, RL05403, 4-(Naphthalene-1-yl)phenylboronic acid, AK-46239, BR-46239

Molecular Formula:	C₁₆H₁₃BO₂	Molecular Weight:	248.084220 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: BQHVXFQXTOIMQM-UHFFFAOYSA-N

• Boronic acid, B-[4-(2-naphthalenyl)phenyl]-

IUPAC Name: (4-naphthalen-2-ylphenyl)boronic acid | CAS Registry Number: 918655-03-5
Synonyms: 4-(naphthalen-2-yl)phenylboronic acid, 4-(2-NAPHTHYL)PHENYLBORONIC ACID, 4-(naphthalen-2-yl)phenylboronicacid, AG-H-77291, 4-(naphthalen-2-yl)phenyl boronic acid, PubChem14004, ACMC-209rdu, SureCN1889241, KSC485M8L, CTK3I5685, 4-(2-Naphthyl)phenylboronic acid,, ACT05127, ANW-39760, SBB071365, AKOS015855883, 4-(naphthalene-2-yl)phenylboronic acid, AK-46240, BR-46240, KB-33930, FT-0630006

Molecular Formula:	C₁₆H₁₃BO₂	Molecular Weight:	248.084220 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: ICQAKBYFBIWELX-UHFFFAOYSA-N

• Calcitriol

IUPAC Name: (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol | CAS Registry Number: 32222-06-3
Synonyms: calcitriol, Rocaltrol, Calcijex, Topitriol, Soltriol, Vectical, Asentar, Silkis, vit D, Rocaltrol (TN), Dihydroxyvitamin D3, 1,25-Dihydroxyvitamin D, Ambap3896, 1db1, 1alpha,25-Dihydroxyvitamin D3, Spectrum5_002061, Calcitriolum [INN-Latin], 1alpha,25(OH)2D3, 1,25-Dihydroxyvitamin D3, 1alpha,25(OH)2-D3

Molecular Formula:	C₂₇H₄₄O₃	Molecular Weight:	416.636460 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: GMRQFYUYWCNGIN-NKMMMXOESA-N

• Capecitabine

IUPAC Name: pentyl N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoro-2-oxopyrimidin-4-yl]carbamate | CAS Registry Number: 154361-50-9
Synonyms: Xeloda, CAPECITABINE, Capecitabine [USAN], Xeloda (TN), Capecitabine (JAN/USAN/INN), C15H22FN3O6, Ro 09-1978, DB01101, Ro-09-1978, LS-59070, N(4)-Pentyloxycarbonyl-5'-deoxy-5-fluorocytidine, Ro 09-1978/000, R-340, 5'-Deoxy-5-fluoro-N-((pentyloxy)carbonyl)cytidine, C12650, D01223, C110904, Cytidine, 5'-deoxy-5-fluoro-N-((pentyloxy)carbonyl)-, Pentyl 1-(5-deoxy-beta-D-ribofuranosyl)-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinecarbamate, Carbamic acid, (1-(5-deoxy-beta-D-ribofuranosyl)-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinyl)-, pentyl ester

Molecular Formula:	C₁₅H₂₂FN₃O₆	Molecular Weight:	359.350083 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: GAGWJHPBXLXJQN-UORFTKCHSA-N

• Carbamic acid, N-(4-aminobutyl)-N-methyl-, 1,1-dimethylethyl ester

IUPAC Name: tert-butyl N-(4-aminobutyl)-N-methylcarbamate | CAS Registry Number: 144222-23-1
Synonyms: N-Boc-N-Methyl-butane-1,4-diamine, tert-butyl 4-aminobutyl(methyl)carbamate, SBB054142, n-(4-aminobutyl)-n-methyl carbamic acid tert-butyl ester, (4-amino-butyl)-methyl-carbamic acid tert-butyl ester, N-(4-Aminobutyl)-N-methyl carbamic acid tert-butyl, AC1MBTFK, ACMC-209cs8, CTK7E8030, MolPort-000-150-967, ACT03168, n-(4-aminobutyl)-n-boc-methylamine, ANW-20838, tert-butyl 4-aminobutylmethylcarbamate, AKOS005258636, AC-2383, AG-C-19023, RP25952, AK-38987, BR-38987

Molecular Formula:	C₁₀H₂₂N₂O₂	Molecular Weight:	202.293880 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: CIZQQISFIQZTDF-UHFFFAOYSA-N

• CBZ-Valganciclovir

IUPAC Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxypropyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate | CAS Registry Number: 194154-40-0
Synonyms: Cbz-Valine ganciclovir, CBZ-valganciclovir, SureCN14125271, CTK4E1452, AKOS015896090, N-Carbobenzyloxy-L-valinyl-ganciclovir, AG-E-41922, FT-0652306, ST51053203, I06-1706, L-Valine,N-[(phenylmethoxy)carbonyl]-,2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-3-hydroxypropyl ester;2-(2-Amino-1,6-dihydro-6-oxo-purin-9-yl)methoxy-3-hydroxy-1-propyl N-(benzyloxycarbonyl)-L-valinate;N-[(Phenylmethoxy)carbonyl]-L-valine 2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-3-hydroxypropyl ester;, N-[(Phenylmethoxy)carbonyl]-L-valine 2-[(2-Amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-3-hydroxypropyl Ester

Molecular Formula:	C₂₂H₂₈N₆O₇	Molecular Weight:	488.493720 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: UMWCZUCRFYVVAW-LYKKTTPLSA-N

• Cefotaxime

IUPAC Name: sodium (6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate | CAS Registry Number: 64485-93-4
Synonyms: Claforan, Cefotax, CEFOTAXIME SODIUM, Claforan (TN), Prestwick_823, Cefotaxim sodium salt, CEFOTAXIME SODIUM SALT, C7039_SIGMA, C7912_SIGMA, Cefotaxime sodium (JP15/USP), HR-756, NCGC00093734-01, EU-0100278, C08113, D00919, CTX

Molecular Formula:	C₁₆H₁₆N₅NaO₇S₂	Molecular Weight:	477.447310 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	10

InChIKey: AZZMGZXNTDTSME-JUZDKLSSSA-M

• Ceftriaxone Disodium

IUPAC Name: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(2-methyl-5,6-dioxo-1H-1,2,4-triazin-3-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 74578-69-1
Synonyms: ceftriaxone, Biotrakson, Rocephin, Cefatriaxone, Ceftriaxon, Ceftriazone, Longacef, Longaceph, Rocephine, Rocefin, Ceftriaxone (TN), Ceftriaxone (INN), Ceftriaxone intravenous, Ceftriaxone [USAN:JAN], Ceftriaxonum [INN-Latin], Ceftriaxona [INN-Spanish], Ceftriaxone, Disodium Salt, DRG-0071, EINECS 277-405-6, C18H18N8O7S3

Molecular Formula:	C₁₈H₁₈N₈O₇S₃	Molecular Weight:	554.579920 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	11

InChIKey: VAAUVRVFOQPIGI-SPQHTLEESA-N

• Cyclobutanecarboxylic Acid, 1-Amino-, Ethyl Ester, Hydrochloride (1:1)

IUPAC Name: ethyl 1-aminocyclobutane-1-carboxylate;hydrochloride | CAS Registry Number: 145143-60-8
Synonyms: Ethyl 1-amino-1-cyclobutanecarboxylate monohydrochloride, 1-amino-cyclobutane-carboxylic acid ethyl ester hydrochloride, 1-Amino-cyclobutanecarboxylic acid ethyl ester hydrochloride, ST060255, ethyl 1-aminocyclobutanecarboxylate, chloride, 1-Amino-cyclobutanecarboxylicacidethylesterhydrochloride, ACMC-20al20, SureCN1279280, 596981_ALDRICH, CTK6F4598, SBB003753, AKOS015845267, AG-C-30152, MCULE-2135939074, KB-11126, I14-5305, 1-aminocyclobutanecarboxylic acid ethyl esterhydrochloride, 1-AMINO-CYCLOBUTANE-CARBOXYLIC ACID ETHYL ESTER HCL, 1-Aminocyclobutanecarboxylic acid ethyl ester hydrochloride

Molecular Formula:	C₇H₁₄ClNO₂	Molecular Weight:	179.644560 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: YGAYWFFKRVMVBL-UHFFFAOYSA-N

• Cyclopropylboronic Acid

IUPAC Name: cyclopropylboronic acid | CAS Registry Number: 411235-57-9
Synonyms: Cyclopropylboronic acid, Cyclopropyl Boronic Acid, cyclopropylboranediol, Cyclopropylboronicacid, AG-F-46218, cyclopropyl-boronic acid, Boronocyclopropane, CYPBA, PubChem4014, ACMC-1AMNO, SureCN9068, AC1MC3PW, 1-BORONOCYCLOPROPANE, KSC235O4H, CYCLOPROPANEBORONIC ACID, 597988_ALDRICH, CTK1D5743, B-CYCLOPROPYL-BORONIC ACID, QCR-242, MolPort-000-139-514

Molecular Formula:	C₃H₇BO₂	Molecular Weight:	85.897480 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: WLVKDFJTYKELLQ-UHFFFAOYSA-N

• D-N-Boc-Prolinamide

IUPAC Name: tert-butyl (2R)-2-carbamoylpyrrolidine-1-carboxylate | CAS Registry Number: 70138-72-6
Synonyms: D-1-N-Boc-prolinamide, Boc-D-Proline amide, (R)-tert-butyl 2-carbamoylpyrrolidine-1-carboxylate, tert-butyl (2R)-2-carbamoylpyrrolidine-1-carboxylate, 35150-07-3, (r)-2-carbamoyl-pyrrolidine-1-carboxylic acid tert-butyl ester, n-tboc-d-prolinamide, ZINC02556560, 1-boc-d-prolinamide, L-1-Boc-prolinamide, PubChem9348, AC1MBUGJ, SureCN2225858, CTK7D2308, MolPort-000-151-711, ACT03202, SBB070495, AKOS015841241, AKOS015894508, AG-A-07702

Molecular Formula:	C₁₀H₁₈N₂O₃	Molecular Weight:	214.261520 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: PITJAAIPVBVRAO-SSDOTTSWSA-N

• Dabigatran etexilate mesylate

IUPAC Name: ethyl 3-[[2-[[4-[(Z)-N'-hexoxycarbonylcarbamimidoyl]anilino]methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoate;methanesulfonic acid | CAS Registry Number: 872728-81-9
Synonyms: BIBR 1048MS, Pradaxa, UNII-SC7NUW5IIT, CHEBI:70743, Dabigatran etexilate mesylate [USAN], BIBR 1048 MS, BIBR-1048-MS, CHEMBL1615369, 593282-20-3, AKOS015951091, CCG-213236, CS-1398, AB1008443, FT-0660872, beta-Alanine, N-((2-(((4-((((hexyloxy)carbonyl)amino)iminomethyl)phenyl)amino)methyl)-1-methyl-1h-benzimidazol-5-yl)carbonyl)-N-2-pyridinyl-, ethyl ester, methanesulfonate, Dabigatran etexilate mesylate; N-[[2-[[[4-[[[(Hexyloxy)carbonyl]amino]iminomethyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-|A-alanine ethyl ester monomethanesulfonat, Dabigatran etexilate mesylate|872728-81-9|BIBR 1048MS|Dabigatran etexilate methanesulfonate, Ethyl 3-(((2-(((4-(((hexyloxy)carbonyl)carbamimidoyl)phenyl)amino)methyl)-1-methyl-1h-benzimidazol-5-yl)carbonyl)(pyridin-2-yl)amino)propanoate, methanesulfonate, N-[[2-[[[4-[[[(Hexyloxy)carbonyl]amino]iminomethyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-|A-alanine Ethyl Ester Methanesulfonate

Molecular Formula:	C₃₅H₄₅N₇O₈S	Molecular Weight:	723.838900 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	11

InChIKey: XETBXHPXHHOLOE-UHFFFAOYSA-N

• Dimethyl Benzene

IUPAC Name: 1,3-dimethylbenzene | CAS Registry Number: 1330-20-7
Synonyms: M-XYLENE, m-Xylol, m-Dimethylbenzene, 1,3-Dimethylbenzene, m-Methyltoluene, meta-Xylene, 1,3-Xylene, 3-Xylene, Dimethylbenzene, Benzene, 1,3-dimethyl-, Xylol, m-Xylenes, Xylene, m-, Santosol 150, Xylene, m-isomer, m-Xylene, benzylated, Benzene, dimethyl-, Benzene, m-dimethyl-, 1,3-Dimethylbenzol, XYLENES

Molecular Formula:	C₈H₁₀	Molecular Weight:	106.165000 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: IVSZLXZYQVIEFR-UHFFFAOYSA-N

• Dimethylpiperidin-4-Ylaminedihydrochloride

IUPAC Name: N,N-dimethylpiperidin-4-amine chloride | CAS Registry Number: 4876-59-9
Synonyms: NSC90442, EINECS 225-486-3, 4-(Dimethylammonio)piperidinium dichloride, CID3083874

Molecular Formula:	C₇H₁₆ClN₂-	Molecular Weight:	163.668340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: IDCJGSDAPFXTGB-UHFFFAOYSA-M

• DL-2-(2-Chlorophenyl)glycine

IUPAC Name: 2-amino-2-(2-chlorophenyl)acetic acid | CAS Registry Number: 88744-36-9
Synonyms: ()-2-Chlorophenylglycine, 73187_FLUKA, NSC154921, STK138986, ()-alpha-Amino-2-chlorophenylacetic acid, TL8000917

Molecular Formula:	C₈H₈ClNO₂	Molecular Weight:	185.607620 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: LMIZLNPFTRQPSF-UHFFFAOYSA-N

• Dl-Beta-(4-Hydroxy-3-Methoxy-Phenyl)alanine

IUPAC Name: 3-amino-3-(4-hydroxy-3-methoxyphenyl)propanoic acid | CAS Registry Number: 72076-93-8
Synonyms: dl-beta-(4-hydroxy-3-methoxy-phenyl)alanine, 3-amino-3-(4-hydroxy-3-methoxyphenyl)propanoic acid, 3-Amino-3-(4-hydroxy-3-methoxy-phenyl)-propionic acid, dl-beta-(3-hydroxy-4-methoxyphenyl)alanine, 3-(4-hydroxy-3-methoxy-phenyl)-dl-beta-alanine, (s)-beta-(4-hydroxy-3-methoxy-phenyl)alanine, SureCN5597196, CTK6J6846, MolPort-002-501-520, ANW-73270, AKOS015851895, AG-A-56773, AK105303, DL-?(4-Hydroxy-3-methoxy-phenyl)alanine, KB-29499, (R)-?(4-Hydroxy-3-methoxyphenyl)alanine, DL-A-(4-Hydroxy-3-methoxy-phenyl)alanine, A9397, FT-0630333, A13204

Molecular Formula:	C₁₀H₁₃NO₄	Molecular Weight:	211.214520 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: IGHHJKPPALHKMJ-UHFFFAOYSA-N

• Duloxetine HCL

IUPAC Name: (3S)-N-methyl-3-naphthalen-1-yloxy-3-thiophen-2-ylpropan-1-amine hydrochloride | CAS Registry Number: 136434-34-9
Synonyms: Cymbalta, Duloxetine HCl, Ariclaim, Xeristar, Yentreve, Cymbalta (TN), DULOXETINE HYDROCHLORIDE, C18H19NOS.HCl, Duloxetine hydrochloride [USAN], MLS001401452, Duloxetine hydrochloride (JAN/USAN), CPD000469136, SAM001246523, SMR000469136, LS-172959, LY-248686, LY-264453, D01179, 2-Thiophenepropanamine, N-methyl-gamma-(1-naphthalenyloxy)-, hydrochloride, (gammaS)-, (+)-N-methyl-gamma-(1-napthlenloxy)-2-thiophenepropan-amine hydrochloride

Molecular Formula:	C₁₈H₂₀ClNOS	Molecular Weight:	333.875500 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: BFFSMCNJSOPUAY-LMOVPXPDSA-N

• Entecavir

IUPAC Name: 2-amino-9-[(3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-3H-purin-6-one | CAS Registry Number: 142217-69-4
Synonyms: Baraclude, Entecavir [INN], Entecavir [USAN:INN], HSDB 7334, BMS 200475, CID170343, SQ 34676, NCGC00164563-01, LS-186647, LS-187009, LS-187784, 6H-Purin-6-one, 2-amino-1,9-dihydro-9-((1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-

Molecular Formula:	C₁₂H₁₅N₅O₃	Molecular Weight:	277.279200 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	7

InChIKey: QDGZDCVAUDNJFG-PPSBICQBSA-N

• Ethanone, 1-(2-pyrimidinyl)-

IUPAC Name: 1-pyrimidin-2-ylethanone | CAS Registry Number: 53342-27-1
Synonyms: 1-(2-Pyrimidinyl)ethanone, EC-000.1413

Molecular Formula:	C₆H₆N₂O	Molecular Weight:	122.124640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: SPZUXKZZYDALEY-UHFFFAOYSA-N

• Ethyl 2-aminothiazole-4-carboxylate

IUPAC Name: ethyl 2-amino-1,3-thiazole-4-carboxylate | CAS Registry Number: 5398-36-7
Synonyms: TimTec1_000957, Oprea1_347195, Oprea1_396207, NSC4464, AIDS073075, AIDS-073075, ALBB-005840, NSC 4464, NSC43547, NSC 43547, SBB000178, ZINC01246200, E2339G1, SDCCGMLS-0065431.P001, SDCCGMLS-0065431.P002, NCGC00174941-01, BAS 00084455, ethyl 2-amino-1,3-thiazole-4-carboxylate, AI3-18592, TL8003539

Molecular Formula:	C₆H₈N₂O₂S	Molecular Weight:	172.204920 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: XHFUVBWCMLLKOZ-UHFFFAOYSA-N

• Ethyl 2-aminothiazole-5-carboxylate

IUPAC Name: ethyl 2-amino-1,3-thiazole-5-carboxylate | CAS Registry Number: 32955-21-8
Synonyms: Oprea1_514496, NSC233051, CID314628, ZINC01509680, E2641G1, ethyl 2-amino-1,3-thiazole-5-carboxylate, TL8002486, 2Z-0725

Molecular Formula:	C₆H₈N₂O₂S	Molecular Weight:	172.204920 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: VNZXERIGKZNEKB-UHFFFAOYSA-N

• Ethyl 2-bromothiazole-5-carboxylate

IUPAC Name: ethyl 2-bromo-1,3-thiazole-5-carboxylate | CAS Registry Number: 41731-83-3
Synonyms: 642495_ALDRICH, ZINC00407931, CID3614103, E2650G1

Molecular Formula:	C₆H₆BrNO₂S	Molecular Weight:	236.086340 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: KTYIFXLNIMPSKI-UHFFFAOYSA-N

• Ethyl 4,6-dichloroindole-2-carboxylate

IUPAC Name: ethyl 4,6-dichloro-1H-indole-2-carboxylate | CAS Registry Number: 53995-82-7
Synonyms: ethyl 4,6-dichloro-1H-indole-2-carboxylate, ethyl 4,6-dichloroindole-2-carboxylate, Ethyl4,6-dichloro-1H-indole, 4,6-dichloro-1h-indole-2-carboxylic acid ethyl ester, AG-F-86367, 4,6-dichloroindole-2-carboxylic acid ethyl ester, ZINC02570131, PubChem23782, AC1MC5IR, SureCN1093057, CTK4J9256, MolPort-000-147-581, 4,6-dichloro-1-ethyl-1H-indole, ANW-54748, BBL020614, OR8093, STK893304, WTI-11050, AKOS001476262, AB07295

Molecular Formula:	C₁₁H₉Cl₂NO₂	Molecular Weight:	258.100660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: YLAHLUPONQVSOT-UHFFFAOYSA-N

• Ethyl 5-(4-nitrophenyl)oxazole-4-carboxylate

IUPAC Name: ethyl 5-(4-nitrophenyl)-1,3-oxazole-4-carboxylate | CAS Registry Number: 72030-87-6
Synonyms: ethyl 5-(4-nitrophenyl)oxazole-4-carboxylate, ethyl 5-(4-nitrophenyl)-1,3-oxazole-4-carboxylate, 5-(4-Nitro-phenyl)-oxazole-4-carboxylic acid ethyl ester, SBB024194, AG-G-83021, 5-(4-Nitro-phenyl)-oxazole-4-carboxylicacidethylester, ethyl 5-(4'-nitrophenyl)-1,3-oxazole-4-carboxylate, 5-(4-nitrophenyl)-oxazole-4-carboxylic acid ethyl ester, ACMC-209ole, CTK5D5397, MolPort-000-894-590, ACN-S001804, ACT06440, ANW-36144, STK351227, ZINC02577846, AKOS000314060, AKOS015922054, AB11113, MCULE-9459479232

Molecular Formula:	C₁₂H₁₀N₂O₅	Molecular Weight:	262.218200 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: WFXGNVYQHVQFKU-UHFFFAOYSA-N

• Ethyl 5-hydroxyindole-2-carboxylate

IUPAC Name: ethyl 5-hydroxy-1H-indole-2-carboxylate | CAS Registry Number: 24985-85-1
Synonyms: ZINC02146776, CID90677, EINECS 246-554-9, Ethyl 5-hydroxy-1H-indole-2-carboxylate, ST5407824, TL8002037, H-6350, 1H-Indole-2-carboxylic acid, 5-hydroxy-, ethyl ester

Molecular Formula:	C₁₁H₁₁NO₃	Molecular Weight:	205.209940 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: WANAXLMRGYGCPC-UHFFFAOYSA-N

• Ethyl Ascorbic Acid

IUPAC Name: (2R)-2-[(1S)-1,2-dihydroxyethyl]-3-ethoxy-4-hydroxy-2H-furan-5-one | CAS Registry Number: 86404-04-8
Synonyms: 3-O-Ethylascorbic acid, 3-O-Ethyl-L-ascorbic acid, CCRIS 7479, LS-7385, (5R)-5-[(1S)-1,2-dihydroxyethyl]-4-ethoxy-3-hydroxyfuran-2(5H)-one

Molecular Formula:	C₈H₁₂O₆	Molecular Weight:	204.177280 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: ZGSCRDSBTNQPMS-UJURSFKZSA-N

• Ethyl1-Piperazineacetate

IUPAC Name: ethyl 2-piperazin-1-ylacetate | CAS Registry Number: 40004-08-8
Synonyms: nchembio814-comp8, Ethyl piperazinoacetate, Ethyl 1-piperazineacetate, Ethyl piperazine-1-acetate, 61897_ALDRICH, N-(Carboethoxymethyl)-piperazine, 61897_FLUKA, 1-(Ethoxycarbonylmethyl)piperazine, EINECS 254-745-3, CID207112, ST5407965, 2-(Piperazin-1-yl)-acetic acid ethyl ester

Molecular Formula:	C₈H₁₆N₂O₂	Molecular Weight:	172.224840 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: MTFCXMJOGMHYAE-UHFFFAOYSA-N

• Ganciclovir

IUPAC Name: 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purin-6-one | CAS Registry Number: 82410-32-0
Synonyms: ganciclovir, Cytovene, Vitrasert, Gancyclovir, Hydroxyacyclovir, Citovirax, Cymevene, DHPG, Cymevan, Cymeven, Virgan, HHEMG, Vitrasert (TN), Biolf 62, Cytovene (TN), Ganciclovirum [Latin], nchembio.87-comp3, Prestwick_1068, GANCICLOVIR SODIUM, 2'-Nor-2'-deoxyguanosine

Molecular Formula:	C₉H₁₃N₅O₄	Molecular Weight:	255.230620 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: IRSCQMHQWWYFCW-UHFFFAOYSA-N

• Ganciclovir Sodium

IUPAC Name: sodium 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)purin-1-id-6-one | CAS Registry Number: 107910-75-8
Synonyms: Cytovene, Cytovene IV, Cymevene, GANCICLOVIR SODIUM, Cytovene IV (TN), RS 21592 Sodium, Ganciclovir sodium [USAN], Ganciclovir sodium (USAN), Ganciclovir, Monosodium Salt, C9H12N5O4.Na, Cytovene (Ganciclovir Sodium), LS-127212, D04301, 9-((2-Hydroxy-1-(hydroxymethyl)ethoxy)methyl)guanine, monosodium salt, 6H-Purin-6-one, 1,9-dihydro-2-amino-9-((2-hydroxy-1-(hydroxymethyl)ethoxy)methyl)-, monosodium salt, 6H-Purin-6-one, 2-amino-1,9-dihydro-9-((2-hydroxy-1-(hydroxymethyl)ethoxy)methyl)-, monosodium salt, 82410-32-0

Molecular Formula:	C₉H₁₂N₅NaO₄	Molecular Weight:	277.212450 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	9

InChIKey: JJICLMJFIKGAAU-UHFFFAOYSA-M

• Iloperidone

IUPAC Name: 1-[4-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy]-3-methoxyphenyl]ethanone | CAS Registry Number: 133454-47-4
Synonyms: Zomaril, Fanapt, Fanapta, Fiapta, Iloperidone (USAN/INN), Iloperidone [USAN:INN], CID71360, C24H27FN2O4, ILO-522, CHEBI:113949, HP-873, HP 873, PDSP1_000514, PDSP1_000515, PDSP2_000512, PDSP2_000513, LS-172870, D02666, L001176, Ethanone, 1-(4-(3-(4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl)propoxy)-3-methoxyphenyl)-

Molecular Formula:	C₂₄H₂₇FN₂O₄	Molecular Weight:	426.480583 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	7

InChIKey: XMXHEBAFVSFQEX-UHFFFAOYSA-N

• Imatinib

IUPAC Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide | CAS Registry Number: 152459-95-5
Synonyms: Glivec, Gleevec, Imatinib mesylate, 1iep, 1xbb, sti-571, nchembio.83-comp14, Imatinib [INN:BAN], Imatinib Methansulfonate, nchembio.117-comp23, STI 571, Cgp 57148, CGP 57148B, CCRIS 9076, STI571, STOCK6S-47743, CHEBI:45783, CID5291, DB00619, DB03261

Molecular Formula:	C₂₉H₃₁N₇O	Molecular Weight:	493.602740 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: KTUFNOKKBVMGRW-UHFFFAOYSA-N

• Imatinib Mesylate

IUPAC Name: methanesulfonic acid; 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide | CAS Registry Number: 220127-57-1
Synonyms: Imatinib mesylate, Gleevec, Glivec, Imatinib mesilate, Gleevac, Gleevec (TN), Glivec (TN), Imatinib Methansulfonate, imatinib methanesulfonate, Imatinib mesilate (JAN), sti-571, HSDB 7142, MLS001401456, STI571, CHEBI:31690, STI 571, CGP 57148B, GGP-57148B, CGP 53715, CGP-57148

Molecular Formula:	C₃₀H₃₅N₇O₄S	Molecular Weight:	589.708400 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	10

InChIKey: YLMAHDNUQAMNNX-UHFFFAOYSA-N

• Indole-4-boronic acid

IUPAC Name: 1H-indol-4-ylboronic acid | CAS Registry Number: 220465-43-0
Synonyms: I2051G1, TL8001829

Molecular Formula:	C₈H₈BNO₂	Molecular Weight:	160.965620 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: USJUQEVUEBCLLR-UHFFFAOYSA-N

• Indole-4-carboxaldehyde

IUPAC Name: 1H-indole-4-carbaldehyde | CAS Registry Number: 1074-86-8
Synonyms: 4-Formylindole, 1H-Indole-4-carbaldehyde, 1H-Indole-4-carboxaldehyde, 632422_ALDRICH, NSC337264, ALBB-004801, ZERO/008830, CID333703, ZINC01576624, F2311G1, TL8000263, I-2202

Molecular Formula:	C₉H₇NO	Molecular Weight:	145.157980 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: JFDDFGLNZWNJTK-UHFFFAOYSA-N

• Indole-5-carboxaldehyde

IUPAC Name: 1H-indole-5-carbaldehyde | CAS Registry Number: 1196-69-6
Synonyms: 5-Formylindole, Indole-5-aldehyde, 1H-Indole-5-carbaldehyde, 513830_ALDRICH, ZINC02389301, BB_SC-4604, ALBB-004800, CID589040, F2137G1, I-2203

Molecular Formula:	C₉H₇NO	Molecular Weight:	145.157980 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: ADZUEEUKBYCSEY-UHFFFAOYSA-N

• Indole-5-Carboxylic Acid

IUPAC Name: 1H-indole-5-carboxylic acid | CAS Registry Number: 1670-81-1
Synonyms: Indole-5-carboxylic acid, I5400_ALDRICH, 1H-indole-5-carboxylic acid, I2250_SIGMA, 57230_FLUKA, ALBB-006266, EINECS 216-799-6, SBB003951, TL8001286, I-2338, I-2340, InChI=1/C9H7NO2/c11-9(12)7-1-2-8-6(5-7)3-4-10-8/h1-5,10H,(H,11,12

Molecular Formula:	C₉H₇NO₂	Molecular Weight:	161.157380 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: IENZCGNHSIMFJE-UHFFFAOYSA-N

• Indole-6-carboxaldehyde

IUPAC Name: 1H-indole-6-carbaldehyde | CAS Registry Number: 1196-70-9
Synonyms: 6-Formylindole, 1H-indole-6-carbaldehyde, 632406_ALDRICH, ZINC02577867, BB_SC-4710, ALBB-004799, CID2773435, F2138G1, TL8000525, I-2204

Molecular Formula:	C₉H₇NO	Molecular Weight:	145.157980 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: VSPBWOAEHQDXRD-UHFFFAOYSA-N