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Profile: GTH Chimie Fine - Fine Chemicals deals with fine chemicals, chemical intermediates, active pharmaceutical ingredients and nutraceuticals. Our products include (1-benzyl-4-piperidyl)methanol, (1-ethoxyethylidene)malononitrile, (1-propynyl)tributylstannane, (1s,4s)-2-boc-2,5-diazabicyclo(2.2.1)heptane, 3,6-bis(tert.-butyl)carbazole and '1-(tert.-butoxycarbonyl)-3-piperidone.

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• N-Boc-ethylene diamine Hcl
IUPAC Name: tert-butyl N-(2-aminoethyl)carbamate hydrochloride | CAS Registry Number: 79513-35-2
Synonyms: N-Boc-ethylenediamine hydrochloride, CID187200, TL8005378

Molecular Formula: C7H17ClN2O2Molecular Weight: 196.675080 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: XUHJJLCKXZTUJN-UHFFFAOYSA-N

• N-Bromophthalimide
IUPAC Name: 2-bromoisoindole-1,3-dione | CAS Registry Number: 2439-85-2
Synonyms: Ambap192, N-(p-Bromophenyl)phthalimide, 260908_ALDRICH, NSC3525, CID75542, NSC 3525, EINECS 219-467-9, ZINC00404762, 1H-Isoindole-1,3(2H)-dione, 2-bromo-, AI3-18212

Molecular Formula: C8H4BrNO2Molecular Weight: 226.026860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MARXMDRWROUXMD-UHFFFAOYSA-N

• N-Butyl P-Aminobenzoate (Bulamben)
IUPAC Name: butyl 4-aminobenzoate | CAS Registry Number: 94-25-7
Synonyms: butamben, Butesin, Butylcaine, Scuroforme, Planoform, Scuroform, Butesine, Butoform, Butyl keloform, butanylcaine, zyljectin, Butyl 4-aminobenzoate, Butyl aminobenzoate, n-Butyl-p-aminobenzoate, Butyl PABA, Butamben [USAN], N-Butyl p-aminobenzoate, 4-(Butoxycarbonyl)aniline, Butamben (USP), Prestwick_994

Molecular Formula: C11H15NO2Molecular Weight: 193.242300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IUWVALYLNVXWKX-UHFFFAOYSA-N

• N-Cbz-L-2,3-diaminopropionic acid
IUPAC Name: (2R)-3-amino-2-(phenylmethoxycarbonylamino)propanoic acid | CAS Registry Number: 62234-37-1
Synonyms: Z-D-Dap-OH, Z-D-Dpr-OH, (R)-3-Amino-2-(((benzyloxy)carbonyl)amino)propanoic acid, (R)-3-AMINO-2-(CBZ-AMINO)PROPANOIC ACID, Nalpha-Z-D-2,3-Diaminopropionic acid, AmbotzZAA1063, PubChem6265, AC1OCTZ4, Z-D-DAPA-OH, Z-D-DAP, SureCN5624749, 96084_ALDRICH, CBZ-BETA-AMINO-D-ALANINE, 96084_FLUKA, MolPort-003-939-926, ACT04321, ANW-46117, N|A-Z-D-2,3-Diaminopropionic acid, AKOS005146419, AKOS007930330

Molecular Formula: C11H14N2O4Molecular Weight: 238.239860 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: FOXRXVSTFGNURG-SECBINFHSA-N

• N-Cyanoacetylurethane
IUPAC Name: ethyl N-(2-cyanoacetyl)carbamate | CAS Registry Number: 6629-04-5
Synonyms: Cyanoacetylurethan, Ethyl cyanacetylcarbamate, Ethyl cyanoacetylcarbamate, N-Cyanoacetyl ethyl carbamate, WLN: NC1VMVO2, C89005_ALDRICH, EINECS 229-615-4, NSC 59709, CID23112, NSC59709, BRN 1210605, Carbamic acid, (cyanoacetyl)-, ethyl ester, ZINC01689745, KM07667, LS-49182, CARBAMIC ACID, CYANOACETYL-, ETHYL ESTER, 4-03-00-00049 (Beilstein Handbook Reference), SR-01000640793-1, InChI=1/C6H8N2O3/c1-2-11-6(10)8-5(9)3-4-7/h2-3H2,1H3,(H,8,9,10

Molecular Formula: C6H8N2O3Molecular Weight: 156.139320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HSOGVWWWGVFXGF-UHFFFAOYSA-N

• O-Acetyl mandelic Acid
IUPAC Name: 2-acetyloxy-2-phenylacetic acid | CAS Registry Number: 5438-68-6
Synonyms: O-Acetylmandelic acid, Maybridge1_006465, 2-acetyloxy-2-phenylacetic acid, NSC14369, FR-2367, RH 00919, SR-01000633241-1

Molecular Formula: C10H10O4Molecular Weight: 194.184000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OBCUSTCTKLTMBX-UHFFFAOYSA-N

• O-Acetyl mandelic Chloride
IUPAC Name: (2-chloro-2-oxo-1-phenylethyl) acetate | CAS Registry Number: 1638-63-7
Synonyms: Acetylmandelic chloride, 1-(Chloroformyl)benzyl acetate, O-ACETYLMANDELIC CHLORIDE, NSC28337, EINECS 216-674-6, SBB003420, 2-chloro-2-oxo-1-phenylethyl acetate, Benzeneacetyl chloride, .alpha.-(acetyloxy)-

Molecular Formula: C10H9ClO3Molecular Weight: 212.629660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BERNQQVIUAZUHY-UHFFFAOYSA-N

• O-Chloro Paratoluidine
IUPAC Name: 2-chloro-4-methylaniline | CAS Registry Number: 615-65-6
Synonyms: 2-Chloro-4-methylaniline, p-Toluidine, 2-chloro-, Chloro-p-toluidine, 2-Chlor-4-toluidin, 2-CHLORO-P-TOLUIDINE, Benzenamine, 2-chloro-4-methyl-, 4-Amino-2-chlorotoluene, 4-Amino-3-chlorotoluene, 4-Methyl-2-chloroaniline, 2-Chlor-4-toluidin [Czech], CCRIS 2887, WLN: ZR BG D1, HSDB 2059, 125075_ALDRICH, 25038_FLUKA, EINECS 210-440-7, NSC 60120, NSC60120, BRN 0774514, ZINC00388156

Molecular Formula: C7H8ClNMolecular Weight: 141.598120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XGYLSRFSXKAYCR-UHFFFAOYSA-N

• P-Amino-Phenyl Acetic Acid
IUPAC Name: 2-(4-aminophenyl)acetic acid | CAS Registry Number: 1197-55-3
Synonyms: 4-Aminophenylacetic acid, 4-Carboxymethylaniline, 4-Aminobenzeneacetic acid, Benzeneacetic acid, 4-amino-, (p-Aminophenyl)acetic acid, Acetic acid, (p-aminophenyl)-, p-Amino-alpha-toluic acid, (para-Aminophenyl)acetic acid, P-AMINOPHENYLACETIC ACID, CCRIS 3157, Oprea1_658624, A71352_ALDRICH, NSC 7929, EINECS 214-828-7, NSC7929, AIDS019030, AIDS-019030, BRN 2208094, LS-10982, ST5330632

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: CSEWAUGPAQPMDC-UHFFFAOYSA-N

• p-Carboxycinnamic acid
IUPAC Name: 4-(3-hydroxy-3-oxoprop-1-enyl)benzoic acid | CAS Registry Number: 19675-63-9
Synonyms: 4-(2-Carboxyvinyl)benzoic acid, EINECS 243-220-4

Molecular Formula: C10H8O4Molecular Weight: 192.168120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: HAEJSGLKJYIYTB-UHFFFAOYSA-N

• Para Chloro Phthalic Anhydride
IUPAC Name: 5-chloro-2-benzofuran-1,3-dione | CAS Registry Number: 118-45-6
Synonyms: 4-Chlorophthalic anhydride, 5-Chloro-2-benzofuran-1,3-dione, 1,3-Isobenzofurandione, 5-chloro-, EINECS 204-251-9, InChI=1/C8H3ClO3/c9-4-1-2-5-6(3-4)8(11)12-7(5)10/h1-3

Molecular Formula: C8H3ClO3Molecular Weight: 182.560620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BTTRMCQEPDPCPA-UHFFFAOYSA-N

• Para Diethylbenzene (PDEB)
IUPAC Name: 1,4-diethylbenzene | CAS Registry Number: 105-05-5
Synonyms: p-Diethylbenzene, Benzene, p-diethyl-, p-Ethylethylbenzene, Benzene, 1,4-diethyl-, 1,4-DIETHYLBENZENE, Ambap7541, D91004_ALDRICH, HSDB 4083, 32018_FLUKA, 32020_FLUKA, EINECS 203-265-2, LS-29830, C14583, InChI=1/C10H14/c1-3-9-5-7-10(4-2)8-6-9/h5-8H,3-4H2,1-2H

Molecular Formula: C10H14Molecular Weight: 134.218160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: DSNHSQKRULAAEI-UHFFFAOYSA-N

• Pbf-Cl
IUPAC Name: 2,2,4,6,7-pentamethyl-3H-1-benzofuran-5-sulfonyl chloride | CAS Registry Number: 154445-78-0
Synonyms: 2,2,4,6,7-Pentamethyldihydrobenzofuran-5-sulfonyl chloride, 2,2,4,6,7-Pentamethyl-2,3-dihydrobenzofuran-5-sulfonyl chloride, 2,2,4,6,7-pentamethyl-3H-1-benzofuran-5-sulfonyl chloride, AC1N5IOY, 09654_FLUKA, CTK0H4351, MolPort-001-768-506, ACT01869, ANW-64177, OR4473, AKOS015924191, AG-A-25177, AM83878, RL01984, AK-76495, H854, KB-16234, FT-0080609, FT-0601194, M-1334

Molecular Formula: C13H17ClO3SMolecular Weight: 288.790280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HLJKUZUILACRPQ-UHFFFAOYSA-N

• R-(+)-a-Amino-g-butyrolactone Hydrochloride
IUPAC Name: (3R)-3-aminooxolan-2-one;hydrochloride | CAS Registry Number: 104347-13-9
Synonyms: D-Homoserine Lactone hydrochloride, (R)-(+)-alpha-Amino-gamma-butyrolactone hydrochloride, PubChem14743, SureCN1402931, 462470_ALDRICH, D-HOMOSERINE LACTONE HCL, MolPort-003-933-737, ACN-S003045, ACT04295, FD1142, AKOS015849335, D-(+)-Homoserine Lactone Hydrochloride, AK-44454, KB-03356, FT-0654410, (R)-a-amino-gamma-butyrolactone hydrochloride, (R)-(+)-A-Amino-?-butyrolactone hydrochloride, (R)-(+)-|A-Amino-|A-butyrolactone hydrochloride, (R)-(+)- |A-amino-|A-butyrolactone hydrochloride, (R)-(+)-3-Aminotetrahydrofuran-2-one Hydrochloride

Molecular Formula: C4H8ClNO2Molecular Weight: 137.564820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XBKCXPRYTLOQKS-AENDTGMFSA-N

• R-(-)-3-Fluoropyrrolidine Hydrochloride
IUPAC Name: (3R)-3-fluoropyrrolidine;hydrochloride | CAS Registry Number: 136725-55-8
Synonyms: (r)-3-fluoropyrrolidine hydrochloride, (R)-(-)-3-Fluoropyrrolidine hydrochloride, R-3-fluoropyrrolidine hydrochloride, (3R)-3-fluoropyrrolidine hydrochloride, (r)-3-fluoro-pyrrolidine hcl, (r)-(-)-3-fluoropyrrolidinehydrochloride, (3r)-(-)-3-fluoropyrrolidine hydrochloride, sNxDJHbRBBruuUQX@, r-(-)-3-fluoropyrrolidine hydrochloride, AC1MBZS5, SureCN389356, KSC496A6F, 637505_ALDRICH, CTK3J6062, MolPort-000-155-955, ANW-42795, WTI-10373, WTI-10374, AKOS005063428, AKOS015898154

Molecular Formula: C4H9ClFNMolecular Weight: 125.572363 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LENYOXXELREKGZ-PGMHMLKASA-N

• R-4-Benzyl-2-oxazolidinone
IUPAC Name: (4R)-4-(phenylmethyl)-1,3-oxazolidin-2-one | CAS Registry Number: 102029-44-7
Synonyms: MLS001242802, (R)-4-Benzyl-2-oxazolidinone, ZINC04284392, CID2734969, SMR000841429, TL806371, ST5405530

Molecular Formula: C10H11NO2Molecular Weight: 177.199840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OJOFMLDBXPDXLQ-SECBINFHSA-N

• R-4-Isopropyl-2-oxazolidinone
IUPAC Name: (4R)-4-propan-2-yl-1,3-oxazolidin-2-one | CAS Registry Number: 95530-58-8
Synonyms: 339946_ALDRICH, 59658_FLUKA, (R)-4-Isopropyl-2-oxazolidinone, 4-Isopropyl-1,3-oxazolidin-2-one, ZINC02539403, (R)-()-4-Isopropyl-2-oxazolidinone, 2-oxazolidinone, 4-(1-methylethyl)-, InChI=1/C6H11NO2/c1-4(2)5-3-9-6(8)7-5/h4-5H,3H2,1-2H3,(H,7,8

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YBUPWRYTXGAWJX-YFKPBYRVSA-N

• R-4-Phenyl-2-oxazolidinone
IUPAC Name: (4R)-4-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 90319-52-1
Synonyms: 402451_ALDRICH, ZINC00143125, (R)-(-)-4-Phenyl-2-oxazolidinone, TL8005811, (R)-(−)-4-Phenyl-2-oxazolidinone, A00134

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QDMNNMIOWVJVLY-QMMMGPOBSA-N

• R-Phenylglycinol (R-2-amino-2-phenylethanol)
IUPAC Name: 2-amino-2-phenylethanol | CAS Registry Number: 56613-80-0
Synonyms: beta-Aminophenethyl alcohol, Benzeneethanol, beta-amino-, 2-Amino-2-phenylethanol, ChemDiv2_003373, (R)-(-)-2-Phenylglycinol, Phenethyl alcohol, beta-amino-, d(-)-.alpha.-Phenylglycinol, (R)-beta-Aminophenethyl alcohol, alpha-Phenyl-alpha-amino-beta-oxyethane, Benzeneethanol, .beta.-amino-, (R)-, EINECS 260-287-5, NSC617248, NCI60_005172, LS-103052, 7568-92-5

Molecular Formula: C8H11NOMolecular Weight: 137.179040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IJXJGQCXFSSHNL-UHFFFAOYSA-N

• Reinecke Salt
IUPAC Name: azanium; azane; chromium(3+); tetrathiocyanate | CAS Registry Number: 13573-16-5
Synonyms: Reinecke salt, Ammonium reineckate, EINECS 237-003-3, CID159682, AI3-28741, Ammonium diamminetetrakis(thiocyanato-N)chromate(1-), Chromate(1-), diamminetetrakis(thiocyanato-N)-, ammonium, Chromate(1-), diamminetetrakis(thiocyanato-kappaN)-, ammonium, (OC-6-11)-, Chromate(1-), diamminetetrakis(thiocyanato-N)-, ammonium, (OC-6-11)-, 15681-88-6, 16248-93-4, 16985-35-6, 45151-30-2

Molecular Formula: C4H10CrN7S4Molecular Weight: 336.425200 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 10

InChIKey: ZGLIQORZYPZFPW-UHFFFAOYSA-K

• S-4-Isopropyl-2-oxazolidinone
IUPAC Name: (4S)-4-propan-2-yl-1,3-oxazolidin-2-one | CAS Registry Number: 17016-83-0
Synonyms: 298883_ALDRICH, 59660_FLUKA, ZINC04262265, (4S)-(-)-4-Isopropyl-2-oxazolidinone, TL8001333, (S)-(−)-4-Isopropyl-2-oxazolidinone

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YBUPWRYTXGAWJX-RXMQYKEDSA-N

• S-4-Phenyl-2-oxazolidinone
IUPAC Name: (4S)-4-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 99395-88-7
Synonyms: 376698_ALDRICH, 78875_FLUKA, (S)-()-4-Phenyl-2-oxazolidinone, ZINC00143123, (S)-(+)-4-Phenyl-2-oxazolidinone, TL8006065, A00133, InChI=1/C9H9NO2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,11

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QDMNNMIOWVJVLY-MRVPVSSYSA-N

• S-Adenosyl-L-Methionine
IUPAC Name: (2S)-2-amino-4-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl-methylsulfonio]butanoate | CAS Registry Number: 29908-03-0
Synonyms: S-adenosylmethionine, Ademetionine, Donamet, AdoMet, adenosylmethionine, Active methionine, SAMe, Acylcarnitine, Methioninyladenylate, S-adenosyl-L-methionine, L-S-Adenosylmethionine, S Amet, S. Amet, L-Methionine, S-adenosyl-, Methionine, S-adenosyl-, CCRIS 7130, 2-S-adenosyl-L-methionine, C15H24N6O5S, EINECS 249-946-8, AIDS051239

Molecular Formula: C15H22N6O5SMolecular Weight: 398.437380 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: MEFKEPWMEQBLKI-AIRLBKTGSA-N

• Terephthalonitrile
IUPAC Name: benzene-1,4-dicarbonitrile | CAS Registry Number: 623-26-7
Synonyms: p-Phthalodinitrile, p-Dicyanobenzene, 1,4-Dicyanobenzene, p-Benzenedinitrile, p-Pdn, Terephthalodinitrile, 4-Cyanobenzonitrile, 1,4-Benzodinitrile, Tereftalodinitril, Tereftalonitril [Czech], Terephthalic acid dinitrile, Tereftalodinitril [Czech], 1,4-BENZENEDICARBONITRILE, WLN: NCR DCN, Terephthalodinitril [German], Nitril kyseliny tereftalove, D76722_ALDRICH, 1,4-Benzendikarbonitril [Czech], Nitril kyseliny tereftalove [Czech], 86441_FLUKA

Molecular Formula: C8H4N2Molecular Weight: 128.130760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BHXFKXOIODIUJO-UHFFFAOYSA-N

• Tert-Butyl (1s,4s)-2,5-Diazabicyclo[2.2.1]heptane-2-Carboxylate
IUPAC Name: tert-butyl (1S,4S)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate | CAS Registry Number: 113451-59-5
Synonyms: (1S,4S)-2-BOC-2,5-DIAZABICYCLO[2.2.1]HEPTANE, AG-D-33263, (1S,4S)-(-)-2-Boc-2,5-diazabicyclo[2.2.1]heptane, (1S,4S)-N-(tert-Butoxycarbonyl)-2,5-diazabicyclo[2.2.1]heptane, tert-Butyl (1S,4S)-(-)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate, PubChem11461, AC1Q1MVD, SureCN71827, KSC497G3T, tert-butyl (1S,4S)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate, 473049_ALDRICH, CTK3J7339, MolPort-003-934-056, ANW-52451, QC-690, AKOS005259628, LS30037, RP25618, AK-32190, BP-13323

Molecular Formula: C10H18N2O2Molecular Weight: 198.262120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UXAWXZDXVOYLII-YUMQZZPRSA-N

• Tetra Butylphosphonium Acid Acetate
IUPAC Name: acetic acid; tetrabutylphosphanium; acetate | CAS Registry Number: 17786-43-5
Synonyms: CID87304, EINECS 241-764-7, TETRA-n-BUTYL PHOPHONIUM ACETATE, Tetrabutylphosphonium acetate, compound with acetic acid, Tetrabutylphosphonium acetate, monoacetic acid salt, Phosphonium, tetrabutyl-, acetate, compd. with acetic acid (1:1)

Molecular Formula: C20H43O4PMolecular Weight: 378.526781 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: BZPUUPVCWNNZKW-UHFFFAOYSA-M

• Thiacetazone
IUPAC Name: N-[4-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl]acetamide | CAS Registry Number: 104-06-3
Synonyms: Benzothiozane, Thioacetazone, Conteben, Tibon, AMITHIOZONE, Thiosemicarbazone, Benzothiozon, Siocarbazone, Thiacetozone, Thioacetazon, Thioazetazone, Thiocarbazil, Thioparamizon, Thioparamizone, Thiotebicina, Tioatsetazon, Ambathizon, Benthiozone, Tebethione, Thiacetone

Molecular Formula: C10H12N4OSMolecular Weight: 236.293480 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: SRVJKTDHMYAMHA-WUXMJOGZSA-N

• Trans-2,4-Dichlorocinnamic Acid
IUPAC Name: (E)-3-(2,4-dichlorophenyl)prop-2-enoic acid | CAS Registry Number: 20595-45-3
Synonyms: 2,4-DICHLOROCINNAMIC ACID, Cinnamic acid, 2,4-dichloro-, WLN: QV1U1R BG DG, HSDB 2811, NSC2076, 144622_ALDRICH, NSC 2076, EINECS 214-860-1, trans-2,4-Dichlorocinnamic acid, 2-Propenoic acid, 3-(2,4-dichlorophenyl)-, 3-(2,4-Dichlorophenyl)-2-propenoic acid, NSC52174, Cinnamic acid, 2,4-dichloro-, (E)-, CID688026, STK397303, AI3-16649, LS-54076, 2-Propenoic acid, 3-(2,4-dichlorophenyl)-, (E)-, (2E)-3-(2,4-dichlorophenyl)prop-2-enoic acid, 2-Propenoic acid, 3-(2,4-dichlorophenyl)- (9CI)

Molecular Formula: C9H6Cl2O2Molecular Weight: 217.048740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MEBWABJHRAYGFW-DUXPYHPUSA-N

• Triacetonediamine
IUPAC Name: 2,2,6,6-tetramethylpiperidin-4-amine | CAS Registry Number: 36768-62-4
Synonyms: Oprea1_368363, 2,2,6,6-Tetramethyl-4-aminopiperidine, 4-Piperidinamine, 2,2,6,6-tetramethyl-, 115738_ALDRICH, 4-Amino-2,2,6,6-tetramethylpiperidine, EINECS 253-197-2, ZERO/001605, NSC 102510, 2,2,6,6-Tetramethyl-4-piperidylamine, BRN 0105038, NSC102510, AI3-60306, LS-114226, PIPERIDINE, 4-AMINO-2,2,6,6-TETRAMETHYL-, 5-22-08-00162 (Beilstein Handbook Reference), 118326-87-7

Molecular Formula: C9H20N2Molecular Weight: 156.268500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FTVFPPFZRRKJIH-UHFFFAOYSA-N

• Tris(2-carboxyethyl)phosphine
IUPAC Name: 3-bis(3-oxido-3-oxopropyl)phosphanylpropanoate | CAS Registry Number: 51805-45-9
Synonyms: ZINC02517013, CID7015766

Molecular Formula: C9H12O6P-3Molecular Weight: 247.161741 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: PZBFGYYEXUXCOF-UHFFFAOYSA-K

• X-GAL (5-Bromo-4 Chloro-3-Indolyl-B-D-Galactopyranoside)
IUPAC Name: (2S,3R,4S,5R,6R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 7240-90-6
Synonyms: X-Gal, BCIG, Maybridge4_000550, B4252_SIAL, B6024_SIAL, B9146_SIAL, EINECS 230-640-8, ZINC03861793, IDI1_031132, ST5319369, 5-Bromo-4-chloro-3-indolyl beta-galactoside, 5-Bromo-4-chloro-3-indolyl beta-D-galactoside, 5-Bromo-4-chloro-3-indolyl beta-D-galactopyranoside, 5-Bromo-4-chloroindol-3-yl-beta-D-galactopyranoside, SR-01000631716-1, beta-D-Galactopyranoside, 5-bromo-4-chloro-1H-indol-3-yl

Molecular Formula: C14H15BrClNO6Molecular Weight: 408.629000 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 7

InChIKey: OPIFSICVWOWJMJ-AEOCFKNESA-N

• Z-Lys(Boc)-OH
IUPAC Name: (4S)-4-(phenylmethyl)-1,3-oxazolidin-2-one | CAS Registry Number: 90719-32-7
Synonyms: (S)-4-Benzyl-2-oxazolidinone, 294640_ALDRICH, 13616_FLUKA, CID736225, ZINC00156419, ZINC04284392, SB 02020, TL8005821, InChI=1/C10H11NO2/c12-10-11-9(7-13-10)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12

Molecular Formula: C10H11NO2Molecular Weight: 177.199840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OJOFMLDBXPDXLQ-VIFPVBQESA-N

• Z-NVA-OH
IUPAC Name: (2S)-2-(phenylmethoxycarbonylamino)pentanoic acid | CAS Registry Number: 21691-44-1
Synonyms: (S)-2-(((Benzyloxy)carbonyl)amino)pentanoic acid, Cbz-L-Norvaline, Z-L-norvaline, Z-Nva-OH, AC1ODTKB, SureCN265461, Z-CBZ-L -NORVALINE, KSC493K4R, CTK3J3548, MolPort-003-986-147, ANW-58704, AKOS015836898, AM82601, AK-76470, TL806320, (2S)-2-(phenylmethoxycarbonylamino)pentanoic acid, (2S)-2-{[(benzyloxy)carbonyl]amino}pentanoic acid, I14-62132

Molecular Formula: C13H17NO4Molecular Weight: 251.278380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NSJDRLWFFAWSFP-NSHDSACASA-N

• 6,7-Dihydro-4-benzo[b]thiophenone
IUPAC Name: 6,7-dihydro-5H-1-benzothiophen-4-one | CAS Registry Number: 13414-95-4
Synonyms: K3603_ALDRICH, NCIOpen2_002165, 4-Oxo-4,5,6,7-tetrahydrothianaphthene, NSC99002, 37282_FLUKA, 4,5,6,7-Tetrahydro-4-benzothiophenone, AIDS126117, AIDS-126117, 4,5,6,7-Tetrahydrothionaphthen-4-one, EINECS 236-510-7, 4,5,6,7-Tetrahydro-4-oxothionaphthene, NSC 99002, ZINC00388535, 4-Keto-4,5,6,7-tetrahydrothianaphthene, 6,7-dihydro-5H-benzothiophen-4-one, 4,5,6, 7-Tetrahydrothionaphthen-4-one, 4,5,6, 7-Tetrahydro-4-oxothionaphthene, 6,7-Dihydro-1-benzothiophen-4(5H)-one, 6,7-Dihydrobenzo(b)thiophen-4(5H)-one, 6,7-Dihydrobenzo[b]thiophen-4(5H)-one

Molecular Formula: C8H8OSMolecular Weight: 152.213520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GJEKNELSXNSYAQ-UHFFFAOYSA-N

• 2H-1,3-Benzoxazine-2,4(3H)-dione
IUPAC Name: 1,3-benzoxazine-2,4-dione | CAS Registry Number: 2037-95-8
Synonyms: Beaprine, Carsalam, Ruhmal, Oxophenhydroxazine, Oxobenzhydroxazin, Oxophenhydroxazin, Carsalamum [INN-Latin], Carsalamo [INN-Spanish], Carsalam [BAN:DCF:INN], Carsalam [INN:BAN:DCF], C8H5NO3, 1,3-Benzoxazine-2,4-dione, 466174_ALDRICH, 2H-1,3-BENZOXAZINE-2,4(3H)-DIONE, 4H-1,3-Benzoxazine-2,4(3H)-dione, NSC 36166, CID16258, NSC36166, BRN 0136767, SBB003929

Molecular Formula: C8H5NO3Molecular Weight: 163.130200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OAYRYNVEFFWSHK-UHFFFAOYSA-N

• 4-Bromo-2-methoxyphenol
IUPAC Name: 4-bromo-2-methoxyphenol | CAS Registry Number: 7368-78-7
Synonyms: 4-Bromoguaiacol, NCIOpen2_005836, Phenol, 4-bromo-2-methoxy-, 533637_ALDRICH, NSC95679, ZINC00158195

Molecular Formula: C7H7BrO2Molecular Weight: 203.033280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WHSIIJQOEGXWSN-UHFFFAOYSA-N

• 3-Chloro-4-hydroxybenzonitrile
IUPAC Name: 3-chloro-4-hydroxybenzonitrile | CAS Registry Number: 2315-81-3
Synonyms: Ambap6898, ZINC02380632, Benzonitrile, 3-chloro-4-hydroxy-, CID2735739

Molecular Formula: C7H4ClNOMolecular Weight: 153.565760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CRYPJUOSZDQWJZ-UHFFFAOYSA-N

• 5-Bromothiophene-2-carboxaldehyde
IUPAC Name: 5-bromothiophene-2-carbaldehyde | CAS Registry Number: 4701-17-1
Synonyms: 5-Bromothenaldehyde, 5-Bromo-2-thiophenecarboxaldehyde, 152625_ALDRICH, 5-Bromo-2-thiophenecarbaldehyde, 5-Bromothiophene-2-carbaldehyde, 2-Bromo-5-thiophenecarboxaldehyde, ZINC00032313, CID78428, EINECS 225-176-8, 2-Thiophenecarboxaldehyde, 5-bromo-, SBB000294, TL8006906

Molecular Formula: C5H3BrOSMolecular Weight: 191.045720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GFBVUFQNHLUCPX-UHFFFAOYSA-N

• 5-Chloro-2-(trichloromethyl)benzimidazole
IUPAC Name: 6-chloro-2-(trichloromethyl)-1H-benzimidazole | CAS Registry Number: 3584-66-5
Synonyms: 192538_ALDRICH, EINECS 222-713-8, NSC158057, ZINC03861386, AI3-51050, 5-Chloro-2-(trichloromethyl)-1H-benzimidazole, 1H-Benzimidazole, 5-chloro-2-(trichloromethyl)-

Molecular Formula: C8H4Cl4N2Molecular Weight: 269.942760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SIZGSKQSWJIWFP-UHFFFAOYSA-N

• 2-Bromomethyl-1,4-benzodioxane
IUPAC Name: 2-(bromomethyl)-2,3-dihydro-1,4-benzodioxine | CAS Registry Number: 2164-34-3
Synonyms: 632643_ALDRICH, EINECS 218-503-0, NSC106871, SBB003290, 2-(Bromomethyl)-2,3-dihydro-1,4-benzodioxin

Molecular Formula: C9H9BrO2Molecular Weight: 229.070560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QYLFKNVZIFTCIY-UHFFFAOYSA-N

• 2-Bromobenzothiazole
IUPAC Name: 2-bromo-1,3-benzothiazole | CAS Registry Number: 2516-40-7
Synonyms: 2-Bromo-1,3-benzothiazole, benzothiazole, 2-bromo-, ZINC00158626, CC 06010, TL8002046, InChI=1/C7H4BrNS/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4

Molecular Formula: C7H4BrNSMolecular Weight: 214.082360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DRLMMVPCYXFPEP-UHFFFAOYSA-N

• 2-Amino-4-chlorobenzothiazole
IUPAC Name: 4-chloro-1,3-benzothiazol-2-amine | CAS Registry Number: 19952-47-7
Synonyms: 2-Benzothiazolamine, 4-chloro-, 2-AMINO-4-CHLOROBENZOTHIAZOLE, 4-Chlorobenzothiazol-2-ylamine, Benzothiazole, 2-amino-4-chloro-, MLS000678672, MLS002152865, 133434_ALDRICH, EINECS 243-439-5, CID29872, NSC44404, BRN 0136784, 4-Chloro-1,3-benzothiazol-2-amine, LS-980, SBB000250, ZINC00119425, NCGC00091638-01, SMR000323910, 4-27-00-04859 (Beilstein Handbook Reference), InChI=1/C7H5ClN2S/c8-4-2-1-3-5-6(4)10-7(9)11-5/h1-3H,(H2,9,10

Molecular Formula: C7H5ClN2SMolecular Weight: 184.646000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OEQQFQXMCPMEIH-UHFFFAOYSA-N

• 6-Bromo-2-benzothiazolinone
IUPAC Name: 6-bromo-3H-1,3-benzothiazol-2-one | CAS Registry Number: 62266-82-4
Synonyms: 441910_ALDRICH, ZINC00135710, CID188444, SL-02095, ST5307652, InChI=1/C7H4BrNOS/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10

Molecular Formula: C7H4BrNOSMolecular Weight: 230.081760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HECJMTPEVWQFCY-UHFFFAOYSA-N

• 5-chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde
IUPAC Name: 5-chloro-3-methyl-1-phenylpyrazole-4-carbaldehyde | CAS Registry Number: 947-95-5
Synonyms: 433853_ALDRICH, ZINC00035783, ALBB-004688, CID613027, SBB000598, 5-Chloro-3-methyl-1-phenyl-4-pyrazolecarboxaldehyde, 5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde, Pyrazole-4-carboxaldehyde, 5-chloro-3-methyl-1-phenyl-, 1H-Pyrazole-4-carboxaldehyde, 5-chloro-3-methyl-1-phenyl-

Molecular Formula: C11H9ClN2OMolecular Weight: 220.654960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DKZPJLZXLKAMDO-UHFFFAOYSA-N

• 1-(4-chlorophenyl)-1H-pyrrole
IUPAC Name: 1-(4-chlorophenyl)pyrrole | CAS Registry Number: 5044-38-2
Synonyms: 1-(4-Chlorophenyl)pyrrole, ChemDiv2_003440, Pyrrole, 1-(p-chlorophenyl)-, Maybridge1_002870, 1-(4-Chlorophenyl)-1H-pyrrole, 1H-Pyrrole, 1-(4-chlorophenyl)-, DivK1c_001622, 452947_ALDRICH, NB-178, NSC116796, AIDS126596, AIDS-126596, CID272425, ZINC00138294, NSC 116796, CDS1_000582, ST5405918, EU-0032749, InChI=1/C10H8ClN/c11-9-3-5-10(6-4-9)12-7-1-2-8-12/h1-8

Molecular Formula: C10H8ClNMolecular Weight: 177.630220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LTOQUFIOYDCJFJ-UHFFFAOYSA-N

• (Methoxycarbonylsulfamoyl)triethylammonium hydroxide
IUPAC Name: 1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate | CAS Registry Number: 29684-56-8
Synonyms: Burgess reagent, MCSTA, 365483_ALDRICH, Methyl N-(triethylammoniosulfonyl)carbamate, ((Methoxycarbonyl)sulfamoyl)triethylammonium, ST5306903, (Methoxycarbonylsulfamoyl)triethylammonium hydroxide, inner salt, Ethanaminium, N,N-diethyl-N-(((methoxycarbonyl)amino)sulfonyl)-, inner salt, 51373-37-6

Molecular Formula: C8H18N2O4SMolecular Weight: 238.304520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: YSHOWEKUVWPFNR-UHFFFAOYSA-N

• 2,6-Di-tert-butyl-4-methoxyphenol
IUPAC Name: 2,6-ditert-butyl-4-methoxyphenol | CAS Registry Number: 489-01-0
Synonyms: Topanol 354, 3,5-Di-tert-butyl-4-hydroxyanisole, CCRIS 5219, 2,6-DI-TERT-BUTYL-4-METHOXYPHENOL, 251062_ALDRICH, 3,5-di-t-Butyl-4-hydroxyanisole, 34713_FLUKA, EINECS 207-693-0, NSC 14451, NSC14451, Phenol, 2,6-di-tert-butyl-4-methoxy-, ZINC00056595, 2,6-Bis(1,1-dimethylethyl)-4-methoxyphenol, Phenol, 2,6-bis(1,1-dimethylethyl)-4-methoxy-, LS-104066, ST5306893, Phenol, 2,6-di-tert-butyl-4-methoxy- (8CI), 1,3-DITERT.BUTYL,2-HYDROXY,5-METHOXY-BENZENE, InChI=1/C15H24O2/c1-14(2,3)11-8-10(17-7)9-12(13(11)16)15(4,5)6/h8-9,16H,1-7H

Molecular Formula: C15H24O2Molecular Weight: 236.349860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SLUKQUGVTITNSY-UHFFFAOYSA-N

• 3-Chloropropionaldehyde diethylacetal
IUPAC Name: 3-chloro-1,1-diethoxypropane | CAS Registry Number: 35573-93-4
Synonyms: 3-Chloro-1,1-diethoxypropane, Propane, 3-chloro-1,1-diethoxy-, 26130_FLUKA, NSC60136, EINECS 252-623-4, ZINC01690015, .beta.-Chloropropionaldehyde diethyl acetal, InChI=1/C7H15ClO2/c1-3-9-7(5-6-8)10-4-2/h7H,3-6H2,1-2H

Molecular Formula: C7H15ClO2Molecular Weight: 166.645800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NXHONHDWVLPPCS-UHFFFAOYSA-N

• 1-Bromo-4-butylbenzene
IUPAC Name: 1-bromo-4-butylbenzene | CAS Registry Number: 41492-05-1
Synonyms: 4-Bromo-n-butylbenzene, 1-Bromo-4-n-Butylbenzene, ST50405192, 4-n-Butylbromobenzene, PubChem15109, ACMC-209jkm, AC1LAV2E, AC1Q2VDY, 1-(4-Bromophenyl)butane, SureCN687846, 1-Bromo-4-ButYl-Benzene, 4-(But-1-yl)bromobenzene, KSC106O7D, 335762_ALDRICH, 1-Bromo-4-(but-1-yl)benzene, MolPort-001-759-142, ANW-29636, ZINC02390036, AKOS005256901, LS11195

Molecular Formula: C10H13BrMolecular Weight: 213.114220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BRGVKVZXDWGJBX-UHFFFAOYSA-N

• (R)-(-)-2-Amino-2-methylbutanedioic acid
IUPAC Name: (2R)-2-azaniumyl-2-methylbutanedioate | CAS Registry Number: 14603-76-0
Synonyms: ZINC01655433

Molecular Formula: C5H8NO4-Molecular Weight: 146.121320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CWAYDJFPMMUKOI-RXMQYKEDSA-M


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