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 4-Butylpiperidine Hydrochloride Suppliers > Shanghai Ennopharm Co., Ltd.

Shanghai Ennopharm Co., Ltd.

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Contact: Yoki Bao - Sales Manager
Web: http://www.ennopharm.com
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Address: Room 505, Building 18B, No.1305 Huajing Road, ECUST Park, Shanghai 201320, China
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Profile: Shanghai Ennopharm Co., Ltd. - Click To Visit Our Website Shanghai Ennopharm Co., Ltd. is a developer of Intermediates. We are dedicated to providing chemical services. By advanced research equipment, sound management and human-oriented culture, we have absorbed a group of chemists with strong academic background.

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Catalogue Products

IDProduct NameCAS NO
EN0000172-propylbenzene-1,3-diol 13331-19-6
EN0000253-methoxy-4-nitrophenol16292-95-8
EN0000411-bromo-4-(difluoromethoxy)Benzene5905-69-1
EN000055methyl 3-cyano-4-hydroxybenzoate156001-68-2
EN0000584-(Difluoromethoxy)phenylboronic acid pinacol ester887757-48-4
EN0000634-ethoxy-5-isopropyl-2-methylbenzaldehyde872183-70-5
EN0000831-(3-chlorophenyl)acetone14123-60-5
EN0000882-(4-fluorophenoxy)ethanamine6096-89-5
EN0000941-(5-bromo-2-fluorophenyl)ethanone198477-89-3

Pyridine | Pyrimidine | Thiazole | Oxazole | Imidazole | Pyrazole

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• N-Boc-4-Amino Piperidine
IUPAC Name: [1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]azanium | CAS Registry Number: 87120-72-7
Synonyms: ZINC04202304, CID7128317

Molecular Formula: C10H21N2O2+Molecular Weight: 201.285940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LZRDHSFPLUWYAX-UHFFFAOYSA-O

• N-BOC-4-METHYL-4-HYDROXY PIPERIDINE
IUPAC Name: tert-butyl 4-hydroxy-4-methylpiperidine-1-carboxylate | CAS Registry Number: 406235-30-1
Synonyms: N-Boc-4-methyl-4-hydroxy piperidine, 1-boc-4-methyl-piperidin-4-ol, 1-Boc-4-Hydroxy-4-methylpiperidine, tert-butyl 4-hydroxy-4-methylpiperidine-1-carboxylate, N-Boc-4-Methyl-4-HydroxyPiperidine, 4-hydroxy-4-methyl-piperidine-1-carboxylic acid tert-butyl ester, SureCN78071, 1-Boc-4-methylpiperidin-4-ol, CTK4I3461, 1-boc-4-methyl-piperidine-4-ol, MolPort-002-499-732, 1-BOC-4-PIPECOLIN-4-OL, ANW-73717, ZINC02539987, AKOS015837000, AB21084, AG-F-44236, LS20684, RL03564, AC-12977

Molecular Formula: C11H21NO3Molecular Weight: 215.289340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SWUCHJAQBNXPBO-UHFFFAOYSA-N

• N-Boc-4-piperidineethanol
IUPAC Name: tert-butyl 4-(2-hydroxyethyl)piperidine-1-carboxylate | CAS Registry Number: 89151-44-0
Synonyms: 1-Boc-4-(2-hydroxyethyl)piperidine, Tert-butyl 4-(2-hydroxyethyl)piperidine-1-carboxylate, N-(tert-Butoxycarbonyl)-4-piperidineethanol, 1-(tert-Butoxycarbonyl)-4-(2-hydroxyethyl)piperidine, 4-(2-HYDROXYETHYL)PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, PubChem16333, ACMC-209qyt, SureCN310405, AC1LGZ19, KSC903S0R, 547247_ALDRICH, CTK8A3908, MolPort-000-001-570, ACT10942, BOC-2-(4-PIPERIDYL)ETHANOL, ANW-39219, FC0432, SBB097482, WT1243, ZINC00404091

Molecular Formula: C12H23NO3Molecular Weight: 229.315920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YBNJZIDYXCGAPX-UHFFFAOYSA-N

• N-Boc-4-piperidinemethanol
IUPAC Name: tert-butyl 4-(hydroxymethyl)piperidine-1-carboxylate | CAS Registry Number: 123855-51-6
Synonyms: 556017_ALDRICH, ARK068, ARONIS012193, ZINC00169576, CID2764081, N-tert-Butyloxycarbonyl-4-piperidinemethanol, TL8000633, 5X-0704, tert-Butyl 4-(hydroxymethyl)-1-piperidinecarboxylate

Molecular Formula: C11H21NO3Molecular Weight: 215.289340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CTEDVGRUGMPBHE-UHFFFAOYSA-N

• N-boc-4-Piperidinol
IUPAC Name: tert-butyl 4-hydroxypiperidine-1-carboxylate | CAS Registry Number: 109384-19-2
Synonyms: 1-Boc-4-piperidinol, 1-Boc-4-hydroxypiperidine, Maybridge3_000273, N-Boc-4-hydroxy-piperidine, 495484_ALDRICH, ARONIS010264, 50408_FLUKA, ZINC00066271, IDI1_011660, ST5307498, TL8000300, tert-Butyl 4-hydroxy-1-piperidinecarboxylate, tert-butyl 4-hydroxypiperidine-1-carboxylate, 1-piperidinecarboxylic acid, 4-hydroxy-, 1,1-dimethylethyl ester, InChI=1/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-8(12)5-7-11/h8,12H,4-7H2,1-3H

Molecular Formula: C10H19NO3Molecular Weight: 201.262760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PWQLFIKTGRINFF-UHFFFAOYSA-N

• N-boc-cis-4-fmoc-Amino-L-Proline
IUPAC Name: (2S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid | CAS Registry Number: 174148-03-9
Synonyms: (4S)-4-N-Fmoc-amino-1-Boc-L-proline, N-Boc-cis-4-Fmoc-Amino-L-proline, N-Boc-cis-4-N-Fmoc-amino-L-proline, (2S,4S)-4-(((9H-fluoren-9-yl)methoxy)carbonylamino)-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylic acid, (2S,4S)-4-(((9H-fluoren-9-yl)methoxy)carbonylamino)-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylicacid, (2S,4S)-N-tert-Butoxycarbonyl-4-N-(9-fluorenylmethoxycarbonyl)aminopyrrolidine-2-carboxylic acid, AC1MBSVI, PubChem13999, cis-4-Amino-L-proline, N1-BOC 4-FMOC protected, SureCN1393299, FMOC(2S,4S)-ABPC, KSC933Q3N, (2S,4S)-Pyrrolidine-2-carboxylic acid, N1-BOC 4-FMOC protected, 534404_ALDRICH, FMOC-ABPC(2S,4S)-OH, CTK8D3836, MolPort-002-500-312, 176486-63-8, ACT05126, AKOS015841279

Molecular Formula: C25H28N2O6Molecular Weight: 452.499620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: UPXRTVAIJMUAQR-BTYIYWSLSA-N

• N-BOC-ETHYLENEDIAMINE (CAS: 79513-35-1)
• N-Boc-hexahydro-1H-azepin-4-one
IUPAC Name: tert-butyl 4-oxoazepane-1-carboxylate | CAS Registry Number: 188975-88-4
Synonyms: Tert-butyl 4-oxoazepane-1-carboxylate, 1-BOC-4-AZEPANONE, N-Boc-4-perhydroazepinone, 1-Boc-homopiperazin-4-one, 4-Oxoazepane-1-carboxylic acid tert-butyl ester, 1-Boc-hexahydro-1H-azepin-4-one, 1-(tert-Butoxycarbonyl)-4-oxoazepane, AG-E-37855, tert-Butyl hexahydro-4-oxo-1H-azepine-1-carboxylate, AC1LTQMR, PubChem17359, BOC-AZEPAN-4-ONE, N-BOC-3-AZAPINONE, SureCN157123, N-BOC AZEPAN-4-ONE, N-BOC-AZEPAN-4-ONE, KSC496K4N, Jsp003880, 00833_FLUKA, CTK3J6546

Molecular Formula: C11H19NO3Molecular Weight: 213.273460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PMLBUVZPRKXMOX-UHFFFAOYSA-N

• N-Boc-L-(+)-Penicillamine
IUPAC Name: (2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanylbutanoic acid | CAS Registry Number: 110763-40-1
Synonyms: AG-D-28461, (R)-2-((tert-Butoxycarbonyl)amino)-3-mercapto-3-methylbutanoic acid, L-Valine,N-[(1,1-dimethylethoxy)carbonyl]-3-mercapto-, CTK4A7047, MolPort-019-903-559, N-BOC-3-MERCAPTO-L-VALINE, ANW-64849, AKOS016005275, AK103379, N-(tert-Butoxycarbonyl)-L-penicillamine;, KB-209682

Molecular Formula: C10H19NO4SMolecular Weight: 249.327160 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: KATRCIRDUXIZQK-ZCFIWIBFSA-N

• N-Boc-N,N-Bis(2-Chloroethyl)amine
IUPAC Name: tert-butyl N,N-bis(2-chloroethyl)carbamate | CAS Registry Number: 118753-70-1
Synonyms: AmbTiB64613, N-Boc-N,N-bis(2-chloroethyl)amine, CID11230235, Tert-butyl N,N-bis(2-chloroethyl)carbamate, B64613

Molecular Formula: C9H17Cl2NO2Molecular Weight: 242.142780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FQZLNQAUUMSUHT-UHFFFAOYSA-N

• N-Boc-Nipecotic acid
IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid | CAS Registry Number: 84358-12-3
Synonyms: Boc-DL-Nip-OH, Boc-DL-nipecotic acid, (R)-Boc-Nip-OH, (R)-Boc-nipecotic acid, Boc-(R)-beta2-Homopro-OH, 495018_ALDRICH, 85405_FLUKA, 89763_FLUKA, ALBB-007043, 1-(Boc)-3-piperidine-carboxylic acid, ()-N-Boc-piperidine-3-carboxylic acid, (R)-N-Boc-piperidine-3-carboxylic acid, FS000017, 1-(tert-Butoxycarbonyl)-3-piperidinecarboxylic acid, 1-(tert-butoxycarbonyl)piperidine-3-carboxylic acid, T5455231

Molecular Formula: C11H19NO4Molecular Weight: 229.272860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: NXILIHONWRXHFA-UHFFFAOYSA-N

• N-Boc-pyrrolidine
IUPAC Name: tert-butyl pyrrolidine-1-carboxylate | CAS Registry Number: 86953-79-9
Synonyms: 1-Boc-Pyrrolidine, tert-butyl pyrrolidine-1-carboxylate, pyrrolidine-1-carboxylic acid tert-butyl ester, ST50824995, ACMC-20aivt, PubChem9422, SureCN5053, 1-Boc-3-Hydropyrrolidine, AC1LD79P, SureCN7858182, KSC491I9N, 427055_ALDRICH, Jsp000752, tert-butyl pyrrolidinecarboxylate, CTK3J1496, MolPort-001-768-806, 1-(tert-Butoxycarbonyl)pyrrolidine, HT728, tert-Butyl 1-pyrrolidinecarboxylate, ACT01708

Molecular Formula: C9H17NO2Molecular Weight: 171.236780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LPQZERIRKRYGGM-UHFFFAOYSA-N

• N-Boc-trans-1,4-cyclohexanediamine
IUPAC Name: tert-butyl N-(4-aminocyclohexyl)carbamate | CAS Registry Number: 177906-48-8
Synonyms: N-Boc-1,4-cyclohexanediamine, BBV-058046, A00057, A00058, 195314-59-1

Molecular Formula: C11H22N2O2Molecular Weight: 214.304580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: FEYLUKDSKVSMSZ-UHFFFAOYSA-N

• N-Boc-Trans-4-Hydroxy-D-Proline
IUPAC Name: (2R,4S)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid | CAS Registry Number: 147266-92-0
Synonyms: (2R,4S)-1-(tert-butoxycarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid, N-boc-trans-4-hydroxy-d-proline, AC1LEMFL, BOC-D-HYP-OH, SureCN873280, Boc-trans-4-Hydroxy-D-proline, CTK8C5243, MolPort-004-969-097, 946610-68-0, ANW-74897, AKOS015836481, AB10145, RL01862, AK-76454, EN001084, KB-01284, N-T-BOC-TRANS-4-HYDROXY-D-PROLINE, AB1006677, FT-0648400, A26574

Molecular Formula: C10H17NO5Molecular Weight: 231.245680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: BENKAPCDIOILGV-NKWVEPMBSA-N

• N-Boc-trans-4-Hydroxy-L-Proline Methylester
IUPAC Name: 1-O-tert-butyl 2-O-methyl (2S,4R)-4-hydroxypyrrolidine-1,2-dicarboxylate | CAS Registry Number: 74844-91-0
Synonyms: 639737_ALDRICH, ZINC00403528, TL8006653, N-Boc-trans-4-hydroxy-L-proline methyl ester, N-BOC-trans-4-hydroxyl-L-proline methyl ester

Molecular Formula: C11H19NO5Molecular Weight: 245.272260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: MZMNEDXVUJLQAF-SFYZADRCSA-N

• N-Carbethoxy-4-Hydroxy Piperidine
IUPAC Name: benzyl 4-oxopiperidine-1-carboxylate | CAS Registry Number: 19099-93-5
Synonyms: 1-Cbz-4-Piperidone, N-Benzyloxycarbonyl-4-piperidone, benzyl 4-oxopiperidine-1-carboxylate, N-CBZ-4-piperidone, Benzyl 4-oxo-1-piperidinecarboxylate, 1-Z-4-Piperidone, 1-(Benzyloxycarbonyl)-4-piperidinone, 1-Cbz-piperidin-4-one, 1-Cbz-4-piperidinone, 1-Carbobenzoxy-4-piperidone, N-CARBOBENZYLOXY-4-PIPERIDONE, N-(Benzyloxycarbonyl)piperidin-4-one, SBB056061, phenylmethyl 4-oxopiperidinecarboxylate, 1-BENZYLOXYCARBONYL-4-PIPERIDONE, 1-piperidinecarboxylic acid, 4-oxo-, phenylmethyl ester, ZINC00155135, PubChem11812, N-CBZ-PIPERIDONE, AC1LD7CY

Molecular Formula: C13H15NO3Molecular Weight: 233.263100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VZOVOHRDLOYBJX-UHFFFAOYSA-N

• N-cyclohexylguanidine
IUPAC Name: 2-cyclohexylguanidine | CAS Registry Number: 14948-83-5
Synonyms: Cyclohexylguanidine, N-Cyclohexylguanidine, Guanidine, cyclohexyl-, Ambnee4002516, MolPort-000-163-756, CID548193, EN001847

Molecular Formula: C7H15N3Molecular Weight: 141.214100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AJGAPBXTFUSKNJ-UHFFFAOYSA-N

• N-cyclohexylguanidine hydrochloride
IUPAC Name: 2-cyclohexylguanidine hydrochloride | CAS Registry Number: 2498-47-7
Synonyms: Cyclohexylguanidine HCl, Cyclohexylguanidine monohydrochloride, EINECS 219-691-7, CID3014107, EN001846

Molecular Formula: C7H16ClN3Molecular Weight: 177.675040 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: RYNCIRCAXCMTCY-UHFFFAOYSA-N

• N-cyclopentylguanidine hydrochloride
IUPAC Name: 2-cyclopentylguanidine hydrochloride | CAS Registry Number: 197015-81-9
Synonyms: MolPort-002-499-053, EN001844

Molecular Formula: C6H14ClN3Molecular Weight: 163.648460 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: IOOJBDSYMIVHQI-UHFFFAOYSA-N

• N-Ethylguanidine hydrochloride
IUPAC Name: (N'-ethylcarbamimidoyl)azanium chloride | CAS Registry Number: 19341-54-9
Synonyms: Ethylguanidine hydrochloride, 503-69-5 (Parent), EINECS 242-974-1, CID29543, GUANIDINE, ETHYL-, MONOHYDROCHLORIDE, LS-73675

Molecular Formula: C3H10ClN3Molecular Weight: 123.584600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GVSGVBVZXJOLDD-UHFFFAOYSA-N

• N-Isopropyl-1-piperazineacetamide
IUPAC Name: 2-piperazin-1-yl-N-propan-2-ylacetamide | CAS Registry Number: 39890-42-1
Synonyms: N-isopropyl-2-piperazin-1-ylacetamide, ALBB-006203, EINECS 254-676-9, NSC379438, 1-Piperazineacetamide, N-(1-methylethyl)-, ST5308459, InChI=1/C9H19N3O/c1-8(2)11-9(13)7-12-5-3-10-4-6-12/h8,10H,3-7H2,1-2H3,(H,11,13

Molecular Formula: C9H19N3OMolecular Weight: 185.266660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: FFOHTSTWXWJGQR-UHFFFAOYSA-N

• N-Methyl-4-Amino Piperidine
IUPAC Name: 1-methylpiperidin-4-amine | CAS Registry Number: 41838-46-4
Synonyms: 1-methylpiperidin-4-amine, 4-Amino-1-methylpiperidine, 4-Amino-1-methyl-piperidine, ALBB-000072, SBB004306, TL8003004

Molecular Formula: C6H14N2Molecular Weight: 114.188760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ALOCUZOKRULSAA-UHFFFAOYSA-N

• N-Methyl-N-(3-pyridin-4-ylbenzyl)amine
IUPAC Name: N-methyl-1-(3-pyridin-4-ylphenyl)methanamine | CAS Registry Number: 852180-67-7
Synonyms: N-methyl(3-(pyridin-4-yl)phenyl)methanamine, AC1OEOZP, N-methyl-1-(3-pyridin-4-ylphenyl)methanamine, CTK8B5150, MolPort-000-143-050, ANW-47758, SBB092333, AKOS010308704, CC35646, N-Methyl-3-(pyridin-4-yl)benzylamine, RP04167, N-methyl-N-(3-pyridin-4-ylbenzyl)amine, AK-50175, BR-50175, EN002388, KB-87549, methyl[(3-(4-pyridyl)phenyl)methyl]amine, 4-{3-[(Methylamino)methyl]phenyl}pyridine, W8797, methyl({[3-(pyridin-4-yl)phenyl]methyl})amine

Molecular Formula: C13H14N2Molecular Weight: 198.263660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PXCMPGTVPUZXRO-UHFFFAOYSA-N

• N-methyl-N-(morpholin-2-ylmethyl)amine hydrochloride
IUPAC Name: N-methyl-1-morpholin-2-ylmethanamine hydrochloride | CAS Registry Number: 122894-43-3
Synonyms: EN000312

Molecular Formula: C6H15ClN2OMolecular Weight: 166.649100 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: NANMGVHRPJHVTP-UHFFFAOYSA-N

• N-methyl-N-phenylpiperidin-4-amine
IUPAC Name: N-methyl-N-phenylpiperidin-4-amine

Molecular Formula: C12H18N2Molecular Weight: 190.284720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BPNDZRDPOYGIMX-UHFFFAOYSA-N

• N-Methylhomopiperazine
IUPAC Name: 1-methyl-1,4-diazepane | CAS Registry Number: 4318-37-0
Synonyms: 1-Methylhomopiperazine, 186090_ALDRICH, NSC21211, 1H-1,4-Diazepine, hexahydro-1-methyl-, Hexahydro-1-methyl-1H-1,4-diazepine

Molecular Formula: C6H14N2Molecular Weight: 114.188760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FXHRAKUEZPSMLJ-UHFFFAOYSA-N

• N-Methylimidazole
IUPAC Name: 1-methylimidazole | CAS Registry Number: 616-47-7
Synonyms: 1-methylimidazole, 1H-Imidazole, 1-methyl-, IMIDAZOLE, 1-METHYL-, 1-Methyl-1H-imidazole, Lopac-M-8878, 1-Methylimidazole solution, WLN: T5N CNJ A1, Lopac0_000831, M50834_ALDRICH, 336092_ALDRICH, 06849_FLUKA, 67560_FLUKA, EINECS 210-484-7, NSC 88064, NSC88064, SBB007574, NCGC00015702-01, NCGC00094162-01, NCGC00094162-02, Cap B (1-methylimidazole 16% in THF)

Molecular Formula: C4H6N2Molecular Weight: 82.103840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MCTWTZJPVLRJOU-UHFFFAOYSA-N

• N-Methylpyrazole
IUPAC Name: 1-methylpyrazole | CAS Registry Number: 930-36-9
Synonyms: 1-Methylpyrazole, 1-Methyl-1H-pyrazole, 1H-Pyrazole, 1-methyl-, Pyrazole, 1-methyl-, 91493_FLUKA, ZERO/005846, ALBB-004426, ZINC01845529, TL8005908, InChI=1/C4H6N2/c1-6-4-2-3-5-6/h2-4H,1H

Molecular Formula: C4H6N2Molecular Weight: 82.103840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UQFQONCQIQEYPJ-UHFFFAOYSA-N

• N-Phenylethylenediamine
IUPAC Name: N-phenylethane-1,2-diamine | CAS Registry Number: 1664-40-0
Synonyms: N-(2-Aminoethyl)aniline, Ethylenediamine, N-phenyl-, 1,2-Ethanediamine, N-phenyl-, N-Phenyl-1,2-ethanediamine, P24152_ALDRICH, Benzenamine, N-(2-aminoethyl)-, NSC84247, 1,2-Ethanediamine, N1-phenyl-, CID74270, Ethylenediamine, N-phenyl- (8CI), EINECS 216-773-4, NSC 84247, BBV-182939

Molecular Formula: C8H12N2Molecular Weight: 136.194280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: OCIDXARMXNJACB-UHFFFAOYSA-N

• N-Phenylpiperazine
IUPAC Name: 1-phenylpiperazin-4-ium | CAS Registry Number: 92-54-6
Synonyms: ZINC00120271, CID3732046

Molecular Formula: C10H15N2+Molecular Weight: 163.239500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YZTJYBJCZXZGCT-UHFFFAOYSA-O

• N-Phenyltrifluoromethane sulphonimide
IUPAC Name: 1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide | CAS Registry Number: 37595-74-7
Synonyms: Phenyl triflimide, 295973_ALDRICH, 78175_FLUKA, N-Phenyltrifluoromethanesulfonimide, N-Phenyl-trifluoromethanesulfonimide, N-Phenyl-bis(trifluoromethanesulfonimide), NSC240874, ZINC01081128, N,N-Bis(trifluoromethylsulfonyl)aniline, N-Phenylbis(trifluoromethanesulphonimide), 3S103817, 3S210817, 1,1,1-Trifluoro-N-phenyl-N-[(trifluoromethyl)sulfonyl]methanesulfonamide

Molecular Formula: C8H5F6NO4S2Molecular Weight: 357.250019 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 11

InChIKey: DIOHEXPTUTVCNX-UHFFFAOYSA-N

• N-propylguanidine sulfate
IUPAC Name: 2-propylguanidine

Molecular Formula: C4H11N3Molecular Weight: 101.150240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: BWMDMTSNSXYYSP-UHFFFAOYSA-N

• n-Propylhydrazine
IUPAC Name: propylhydrazine | CAS Registry Number: 5039-61-2
Synonyms: Propylhydrazine, Hydrazine, propyl-, 1-Propylhydrazine, Ambnee4034715, MolPort-001-786-925, CID42007, LS-190398

Molecular Formula: C3H10N2Molecular Weight: 74.124900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UKPBXIFLSVLDPA-UHFFFAOYSA-N

• N-T-Butylglycine Hydrochloride
IUPAC Name: tert-butyl(carboxymethyl)azanium chloride | CAS Registry Number: 6939-23-7
Synonyms: N-t-Butylglycine HCl, AmbTiB48302, B48302

Molecular Formula: C6H14ClNO2Molecular Weight: 167.633860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QORBVLNEGUIPND-UHFFFAOYSA-N

• N-tert-Butoxycarbonyl-4-piperidinecarbonitrile
IUPAC Name: tert-butyl 4-cyanopiperidine-1-carboxylate | CAS Registry Number: 91419-52-2
Synonyms: 1-Boc-4-cyanopiperidine, 1-N-Boc-4-cyanopiperidine, ZINC01436283, CID1514443, tert-butyl 4-cyano-1-piperidinecarboxylate, TL8005862

Molecular Formula: C11H18N2O2Molecular Weight: 210.272820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UQADQTBQNVARAP-UHFFFAOYSA-N

• N-Trityl-L-Serine Methyl Ester
IUPAC Name: methyl (2S)-3-hydroxy-2-(tritylamino)propanoate | CAS Registry Number: 4465-44-5
Synonyms: AmbTiT21402, N-Trityl-L-serine methyl ester, 411345_ALDRICH, MolPort-000-006-328, NSC129155, ZINC19202575, CID7128367, T21402

Molecular Formula: C23H23NO3Molecular Weight: 361.433620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LXAWQKKSNNYYEK-NRFANRHFSA-N

• N1-(1-Oxo-2,3-dihydro-1H-inden-5-yl)acetamide
IUPAC Name: N-(1-oxo-2,3-dihydroinden-5-yl)acetamide | CAS Registry Number: 58161-35-6
Synonyms: MLS000087840, IFLab1_001751, NSC225099, ZINC00128918, SDCCGMLS-0053079.P002, SMR000024160, ST5133478, EU-0005999, N-(1-Oxo-2,3-dihydro-1H-inden-5-yl)acetamide, SR-01000638785-1, Acetamide, N-(2,3-dihydro-1-oxo-1H-inden-5-yl)-

Molecular Formula: C11H11NO2Molecular Weight: 189.210540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GHUPGGYDRVSZSW-UHFFFAOYSA-N

• N2-Methylpyridine-2,5-Diamine (CAS: 20820-36-2)
• Naproxen Sodium
IUPAC Name: 5-methyl-1H-pyridin-2-one | CAS Registry Number: 1003-68-5
Synonyms: 5-Methyl-2-pyridinol, 5-Methyl-2-pyridone, 2-Hydroxy-5-methylpyridine, 2(1H)-Pyridone, 5-methyl-, NCIOpen2_002095, 2(1H)-Pyridinone, 5-methyl-, 593427_ALDRICH, EINECS 213-713-9, ZINC00152339, SDCCGMLS-0065828.P001, AC 35768, H166, ST5213170, 91914-06-6

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SOHMZGMHXUQHGE-UHFFFAOYSA-N

• Nerispirdine
IUPAC Name: N-(3-fluoropyridin-4-yl)-3-methyl-N-propylindol-1-amine | CAS Registry Number: 119229-65-1
Synonyms: Nerispirdine hydrochloride, UNII-G7M7YWO6CG, HP 184, HP-184, CID3081185, EN002124, N-(3-Fluoro-4-pyridinyl)-3-methyl-N-propyl-1H-indol-1-amine, 1H-Indol-1-amine, N-(3-fluoro-4-pyridinyl)-3-methyl-N-propyl-, N-(n-Propyl)-3-fluoro-4-pyridinyl-1H-3-methylindol-1-amine hydrochloride, 1H-Indol-1-amine, N-(3-fluoro-4-pyridinyl)-3-methyl-N-propyl-, monohydrochloride, 119229-64-0

Molecular Formula: C17H18FN3Molecular Weight: 283.343323 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BTDHTARYCBHHPJ-UHFFFAOYSA-N

• Nifurpirinol
IUPAC Name: [6-[(E)-2-(5-nitrofuran-2-yl)ethenyl]pyridin-2-yl]methanol | CAS Registry Number: 13411-16-0
Synonyms: Furanace, Furpirinol, Furpyrinol, Furanace-10, Furanace (TN), Nifurpirinol (USAN), Nifurpirinol [USAN:INN], Nifurpirinolum [INN-Latin], CCRIS 1046, EINECS 236-503-9, NF 323, C12H10N2O4, BRN 1216943, P 7138, P-7138, LS-131753, 6-(2-(5-Nitro-2-furyl)vinyl)-2-pyridinemethanol, D02513, 2-Pyridinemethanol, 6-(2-(5-nitro-2-furyl)vinyl)-, 6-(2-(5-Nitro-2-furanyl)ethenyl)-2-pyridinemethanol

Molecular Formula: C12H10N2O4Molecular Weight: 246.218800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: JQKHJQJVKRFMCO-SNAWJCMRSA-N

• Nilotinib
IUPAC Name: 4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzamide | CAS Registry Number: 641571-10-0
Synonyms: AMN107, AMN 107, CHEBI:52172, AMN-107, TL8004531, 4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzamide, 4-Methyl-3-((4-(3-pyridinyl)-2-pyrimidinyl)amino)-N-(5-(4-methyl-1H-imidazol-1-yl)-3-(trifluoromethyl)phenyl)benzamide, 4-Methyl-3-(4-(3-pyridinyl)-2-pyrimidinyl)amino)-N-[5-(4-methyl-1H-imidazol-1-yl)-3-(trifluoromethyl)phenyl]benzamide, 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-N-[5-(4-methyl-1H-imidazol-1-yl)-3-(trifluoromethyl)phenyl]benzamide, Benzamide, 4-methyl-N-((3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl)-3-(4-(3-pyridinyl)-2-pyrimidinyl)amino)-, Benzamide, 4-methyl-N-(3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl)-3-(4-(3-pyridinyl)-2-pyrimidinyl)amino)-, benzamide, 4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-, Benzamide, 4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]- (9CI), NIL

Molecular Formula: C28H22F3N7OMolecular Weight: 529.515790 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: HHZIURLSWUIHRB-UHFFFAOYSA-N

• NK-611
IUPAC Name: (5S,5aR,8aR,9R)-5-[[(2R,4aR,6R,7R,8R,8aS)-7-(dimethylamino)-8-hydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one | CAS Registry Number: 105655-99-0
Synonyms: AC1OCEVY, ZINC3914835, (5R)-9alpha-[[4-O,6-O-[(R)-Ethylidene]-2-(dimethylamino)-2-deoxy-beta-D-glucopyranosyl]oxy]-5,8,8abeta,9-tetrahydro-5beta-(4-hydroxy-3,5-dimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aalphaH)-one, (5S,5aR,8aR,9R)-5-[[(2R,4aR,6R,7R,8R,8aS)-7-(dimethylamino)-8-hydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one

Molecular Formula: C31H37NO12Molecular Weight: 615.632 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 13

InChIKey: ZKSNZYLCOXUJIR-VOKUKXJJSA-N

• Norvaline, 4-oxo-
IUPAC Name: (2R)-2-azaniumyl-4-oxopentanoate | CAS Registry Number: 4439-83-2
Synonyms: 2-amino-4-oxopentanoate, CPD-299

Molecular Formula: C5H9NO3Molecular Weight: 131.129860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QUCHWTCTBHQQDU-SCSAIBSYSA-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

• O-Methylisourea hydrochloride
IUPAC Name: methyl carbamimidate hydrochloride | CAS Registry Number: 5329-33-9
Synonyms: O-Methyluronium chloride, 2-Methylpseudourea hydrochloride, NSC1896, NSC 1896, Pseudourea, 2-methyl-, monohydrochloride, Pseudourea, 2-methyl-, monohydrochloride (8CI), Carbamimidic acid, methyl ester, monohydrochloride, Carbamimidic acid, methyl ester, monohydrochloride (9CI), 2440-60-0

Molecular Formula: C2H7ClN2OMolecular Weight: 110.542780 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: MUDVUWOLBJRUGF-UHFFFAOYSA-N

• Octadecanamide
IUPAC Name: octadecanamide | CAS Registry Number: 1243312-32-4
Synonyms: Stearamide, 124-26-5, STEARIC ACID AMIDE, Octadecamide, Octadecylamide, Stearoylamide, Stearoylamine, Stearylamide, Stearic amide, Kemamide S, Adogen 42, CCRIS 6866, HSDB 723, CHEBI:34900, EINECS 204-693-2, NSC 66462, SBB061048, AG-D-51908, BRN 0909006, AI3-10003

Molecular Formula: C18H37NOMolecular Weight: 283.492480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LYRFLYHAGKPMFH-UHFFFAOYSA-N

• octahydro-4H-quinolizin-4-one
IUPAC Name: 1,2,3,6,7,8,9,9a-octahydroquinolizin-4-one

Molecular Formula: C9H15NOMolecular Weight: 153.221500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: KBBXPRPSOFVSSQ-UHFFFAOYSA-N

• octahydro-5H-pyrrolo[1,2-a]azepin-5-one
IUPAC Name: 1,2,3,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepin-5-one

Molecular Formula: C9H15NOMolecular Weight: 153.221500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RNOHOXBYWCWFIQ-UHFFFAOYSA-N

• octahydropyrido[1,2-a][1,4]diazepin-5(2H)-one
IUPAC Name: 2,3,4,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepin-5-one | CAS Registry Number: 1000577-67-2
Synonyms: MolPort-000-140-349, EN000750

Molecular Formula: C9H16N2OMolecular Weight: 168.236140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VFOPBKHLYOFDNX-UHFFFAOYSA-N


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