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• BENZONITRILE,4-HYDROXY-2,3-DIMETHYL-
IUPAC Name: 4-hydroxy-2,3-dimethylbenzonitrile | CAS Registry Number: 448961-58-8
Synonyms: 4-Hydroxy-2,3-dimethylbenzonitrile, AGN-PC-025QLD, SureCN7056620, CTK8I7709, RW2691, AK141932

Molecular Formula: C9H9NOMolecular Weight: 147.173860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LUOBVTFFWKJVTN-UHFFFAOYSA-N

• Benzoylacetonitrile
IUPAC Name: 3-oxo-3-phenylpropanenitrile | CAS Registry Number: 614-16-4
Synonyms: Phenacyl cyanide, Cyanoacetophenone, 2-Cyanoacetophenone, Acetonitrile, benzoyl-, 2-Cyanoacetyl phenone, Cyanomethyl phenyl ketone, Acetophenone, 2-cyano-, 3-Oxo-3-phenylpropanenitrile, alpha-Cyanoacetophenone, omega-Cyanoacetophenone, beta-Oxohydrocinnamonitrile, 3-Phenyl-3-ketopropionitrile, Enamine_005459, .alpha.-Cyanoacetophenone, .omega.-Cyanoacetophenone, beta-oxobenzenepropanenitrile, Benzenepropanenitrile, .beta.-oxo-, Hydrocinnamonitrile, beta-oxo-, 272728_ALDRICH, Acetonitrile, benzoyl- (8CI)

Molecular Formula: C9H7NOMolecular Weight: 145.157980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZJRCIQAMTAINCB-UHFFFAOYSA-N

• Cyclobutylhydrazine
IUPAC Name: cyclobutylhydrazine | CAS Registry Number: 742673-64-9
Synonyms: CYCLOBUTYLHYDRAZINE, AG-G-95135, CYCLOBUTYL-HYDRAZINE, SureCN271691, CTK5D9641, Phosphine,[(4-nitrophenyl)methyl]-, RW2684, AKOS005264444, KB-49174, BB 0260692, S14-0096

Molecular Formula: C4H10N2Molecular Weight: 86.135600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HQFQTTNMBUPQAY-UHFFFAOYSA-N

• Cyclopropane Methyl Amine
IUPAC Name: cyclopropylmethanamine | CAS Registry Number: 2516-47-4
Synonyms: Cyclopropanemethylamine, (Aminomethyl)cyclopropane, Cyclopropanemethanamine, 1-cyclopropylmethanamine, 359521_ALDRICH, 08460_FLUKA, ALBB-005351, EINECS 219-737-6, STK328116, InChI=1/C4H9N/c5-3-4-1-2-4/h4H,1-3,5H

Molecular Formula: C4H9NMolecular Weight: 71.120960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: IGSKHXTUVXSOMB-UHFFFAOYSA-N

• Ethyl 1-Methyl-1H-Imidazole-2-Carboxylate
IUPAC Name: ethyl 1-methylimidazole-2-carboxylate | CAS Registry Number: 30148-21-1
Synonyms: Ethyl 1-Methylimidazole-2-carboxylate, ethyl 1-methyl-1h-imidazole-2-carboxylate, ETHYL1-METHYLIMIDAZOLE-2-CARBOXYLATE, SBB013235, AG-E-98817, ZERO/005211, PubChem22681, AC1N6LG3, SureCN1822302, CTK4G4558, MolPort-001-768-759, ACN-P000764, ACN-S004115, ACT07790, ANW-50540, RW2657, STK735183, ZINC03880843, AKOS003396279, AC-7073

Molecular Formula: C7H10N2O2Molecular Weight: 154.166500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NOTZYDYZBOBDFE-UHFFFAOYSA-N

• Ethyl 4-Oxocyclohexaneacetate
IUPAC Name: ethyl 2-(4-oxocyclohexyl)acetate | CAS Registry Number: 58012-34-3
Synonyms: Ethyl 2-(4-oxocyclohexyl)acetate, SureCN2257497, ethyl 4-oxocyclohexaneacetate, RW2721, AKOS006307852, AK114276, KB-51305, M112047

Molecular Formula: C10H16O3Molecular Weight: 184.232240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XHNJFNLTFMAPQB-UHFFFAOYSA-N

• methyl 3-(2-fluoro-4-methoxyphenyl)propanoate
IUPAC Name: methyl 3-(2-fluoro-4-methoxyphenyl)propanoate | CAS Registry Number: 874187-38-9
Synonyms: SureCN1924061, RW2701, AK141938, Methyl 3-(2-fluoro-4-methoxyphenyl)propanoate

Molecular Formula: C11H13FO3Molecular Weight: 212.217523 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HKQQUWYOQCIJQD-UHFFFAOYSA-N

• methyl 3-(piperidin-4-yl)propanoate hydrochloride
IUPAC Name: methyl 3-piperidin-4-ylpropanoate;hydrochloride | CAS Registry Number: 167414-87-1
Synonyms: Methyl 3-(piperidin-4-yl)propanoate hydrochloride, METHYL3-(4-PIPERIDINYL)PROPANOATE HYDROCHLORIDE, SureCN382045, CTK0A8690, RW2631, AK141917, 4-Piperidinepropanoic acid, methyl ester, hydrochloride

Molecular Formula: C9H18ClNO2Molecular Weight: 207.697720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AZXUUZJIMVNVCN-UHFFFAOYSA-N

• METHYL 6-CHLOROPYRIMIDINE-4-CARBOXYLATE
IUPAC Name: methyl 6-chloropyrimidine-4-carboxylate | CAS Registry Number: 6627-22-1
Synonyms: NSC58346, CID245927

Molecular Formula: C6H5ClN2O2Molecular Weight: 172.569100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: IAEUEOUJKNGPMO-UHFFFAOYSA-N

• N,N-dimethyl-4-(3-piperidinylmethyl)-2-Pyrimidinamine
IUPAC Name: N,N-dimethyl-4-(piperidin-3-ylmethyl)pyrimidin-2-amine | CAS Registry Number: 1359705-77-3
Synonyms: RW2649, AK141922, N,N-Dimethyl-4-(piperidin-3-ylmethyl)pyrimidin-2-amine

Molecular Formula: C12H20N4Molecular Weight: 220.314000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OQDTXZAMLUTVLL-UHFFFAOYSA-N

• N-Ethyl-Benzenemethanamine
IUPAC Name: N-benzylethanamine | CAS Registry Number: 14321-27-8
Synonyms: N-Ethylbenzylamine, Benzylamine der, N-benzylethanamine, N-Benzylethylamine, Benzenemethanamine, N-ethyl-, Benzylamine, N-ethyl-, N-Benzyl-N-ethylamine, N-(phenylmethyl)ethanamine, BENZYL-ETHYL-AMINE, 126993_ALDRICH, EINECS 238-265-1, NSC7413, AIDS011070, AIDS-011070, CID84352, BBR-007304, 5417-36-7 (HYDROCHLORIDE), LS-184962, I01-1150, InChI=1/C9H13N/c1-2-10-8-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H

Molecular Formula: C9H13NMolecular Weight: 135.206220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HVAAHUDGWQAAOJ-UHFFFAOYSA-N

• N-EthylGlycine
IUPAC Name: 2-(ethylazaniumyl)acetate | CAS Registry Number: 627-01-0
Synonyms: N-Ethylglycine, ZINC01532340, CPD-10490, CID6992079

Molecular Formula: C4H9NO2Molecular Weight: 103.119760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YPIGGYHFMKJNKV-UHFFFAOYSA-N

• Tetrahydro-3-(4-Piperidinyl)-2H-1,3-Oxazin-2-One
IUPAC Name: 3-piperidin-4-yl-1,3-oxazinan-2-one | CAS Registry Number: 164518-99-4
Synonyms: 3-(Piperidin-4-yl)-1,3-oxazinan-2-one, SureCN2855915, CTK8C1038, MolPort-012-800-846, ANW-65767, RW2624, AKOS010604995, QC-7748, AK-88996, KB-69971

Molecular Formula: C9H16N2O2Molecular Weight: 184.235540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UAMPFCXIVPCTCN-UHFFFAOYSA-N

• (2R)-2-MethylButanamide
IUPAC Name: (2R)-2-methylbutanamide | CAS Registry Number: 389122-94-5
Synonyms: (R)-2-Methylbutanamide, 2-methyl-(2R)-butanamide, CTK8C1039, ANW-65769, RW2673, QC-8946, AK-88994, KB-68954

Molecular Formula: C5H11NOMolecular Weight: 101.146940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XUXJHBAJZQREDB-SCSAIBSYSA-N

• (4-OXOCYCLOHEXYL)ACETIC ACID, 95%
IUPAC Name: 2-(4-oxocyclohexyl)acetic acid | CAS Registry Number: 52263-23-7
Synonyms: 2-(4-oxocyclohexyl)acetic Acid, 4-oxocyclohexylacetic acid, SureCN336991, Ambcb4018513, MolPort-016-583-154, RW2722, AKOS006280323, MCULE-2016363878, AK118089, KB-204775, M112046

Molecular Formula: C8H12O3Molecular Weight: 156.179080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JZAWBDIRCFFJBI-UHFFFAOYSA-N

• (5-Amino-1h-Benzimidazol-2-Yl)methanol
IUPAC Name: (6-amino-1H-benzimidazol-2-yl)methanol | CAS Registry Number: 294656-36-3
Synonyms: (5-Amino-1H-benzoimidazol-2-yl)-methanol, (5-Aminobenzimidazol-2-yl)methanol, (5-amino-1H-benzimidazol-2-yl)methanol, (5-Amino-1H-benzo[d]imidazol-2-yl)methanol, 3411-71-0, AC1LHIMQ, SureCN520978, SureCN3947749, Oprea1_307912, Oprea1_491938, STOCK6S-44410, CTK4H1759, CTK8D3943, MolPort-000-000-990, HMS1686G17, ANW-62725, BBL012603, RW2655, STK394272, ZINC06493922

Molecular Formula: C8H9N3OMolecular Weight: 163.176560 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: AVKZEQGMZMYWRR-UHFFFAOYSA-N

• (6-Chloro-3-Pyridinyl)-4-MorpholinylMethanone
IUPAC Name: (6-chloropyridin-3-yl)-morpholin-4-ylmethanone | CAS Registry Number: 64614-49-9
Synonyms: Oprea1_611672, ALBB-004234, CID857499, STK503023, ZINC00413111, BBV-047982, 4-[(6-chloropyridin-3-yl)carbonyl]morpholine, (6-chloropyridin-3-yl)(morpholin-4-yl)methanone, (6-chloropyridin-3-yl)-morpholin-4-yl-methanone

Molecular Formula: C10H11ClN2O2Molecular Weight: 226.659540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: FCXXBTYIFBFZML-UHFFFAOYSA-N

• (E)-methyl 3-(2-fluoro-4-methoxyphenyl)acrylate
IUPAC Name: methyl (E)-3-(2-fluoro-4-methoxyphenyl)prop-2-enoate | CAS Registry Number: 1042685-74-4
Synonyms: RW2703, AK141939, (E)-Methyl 3-(2-fluoro-4-methoxyphenyl)acrylate

Molecular Formula: C11H11FO3Molecular Weight: 210.201643 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: YUIHJWVNGQTMNF-GQCTYLIASA-N

• 1,2,3,4-TETRAHYDROBENZO[E][1,4]DIAZEPIN-5-ONE
IUPAC Name: 1,2,3,4-tetrahydro-1,4-benzodiazepin-5-one | CAS Registry Number: 28544-83-4
Synonyms: 1,2,3,4-tetrahydrobenzo(e)(1,4)diazepin-5-one, AG-E-91765, AGN-PC-00NMZO, SureCN700485, CTK4G1690, MolPort-019-904-409, ANW-45023, RW2676, AKOS006327875, QC-2427, AK-86067, KB-216205, W5124, 2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-5-one, 1,2,3,4-tetrahydrobenzo(e)(1,4)diazepin-5-one;, 5H-1,4-Benzodiazepin-5-one,1,2,3,4-tetrahydro-, 3,4-dihydro-1H-benzo[e][1,4]diazepin-5(2H)-one, 5H-1,4-Benzodiazepin-5-one, 1,2,3,4-tetrahydro-

Molecular Formula: C9H10N2OMolecular Weight: 162.188500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: WCNVOWWRJIZZKA-UHFFFAOYSA-N

• 1,2-Dihydro-5,6-Dimethyl-2-Oxo-3-Pyridinecarbonitrile
IUPAC Name: 5,6-dimethyl-2-oxo-1H-pyridine-3-carbonitrile | CAS Registry Number: 72716-80-4
Synonyms: 5,6-Dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile, 5,6-Dimethyl-2-oxo-1,2-dihydro-, AG-G-86441, 1,2-Dihydro-5,6-dimethyl-2-oxo-3-Pyridinecarbonitrile, 1,2-dihydro-5,6-dimethyl-2-oxopyridine-3-carbonitrile, ST50793796, 2-HYDROXY-5,6-DIMETHYLNICOTINONITRILE, 5,6-dimethyl-2-oxo-1H-pyridine-3-carbonitrile, AC1LBX5F, SureCN214847, SureCN2176229, 5,6-Dimethyl-2-oxo-1,2-dihydro-3-pyridinecarbonitrile, CTK5D6690, MolPort-004-748-572, 3-Cyano-5,6-dimethylpyrid-2-one, 3-Cyano-5,6-dimethylpyridin-2-ol, ANW-55958, RW2708, STK954967, ZINC05646404

Molecular Formula: C8H8N2OMolecular Weight: 148.161920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BUGNNHLZTBPABI-UHFFFAOYSA-N

• 1-(2-Aminoethyl)-2-Piperidinone
IUPAC Name: 1-(2-aminoethyl)piperidin-2-one | CAS Registry Number: 27578-61-6
Synonyms: 1-(2-Aminoethyl)piperidin-2-one, 1-(2-aminoethyl)-2-Piperidinone, AGN-PC-01XEEK, Ambcb4014128, SureCN1446472, MolPort-002-013-422, ANW-58466, QC-699, RW2620, 2-Piperidinone, 1-(2-aminoethyl)-, AKOS000558724, AK-81570, KB-63808, BB 0260042

Molecular Formula: C7H14N2OMolecular Weight: 142.198860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RSDYQUTYAZWYEK-UHFFFAOYSA-N

• 1-(6-METHYLPYRIDIN-3-YL)ETHANAMINE 95%
IUPAC Name: 1-(6-methylpyridin-3-yl)ethanamine | CAS Registry Number: 92295-43-7
Synonyms: 1-(6-methylpyridin-3-yl)ethanamine, 1-(6-methyl-3-pyridinyl)ethanamine, 1-(6-METHYL-PYRIDIN-3-YL)-ETHYLAMINE, SureCN594622, Ambcb4014888, CTK5H1110, MolPort-008-421-278, RW2714, 1-(6-methylpyridin-3-yl)-ethylamine, AKOS012457499, AB53828, AG-H-78519, QC-8900, AK-70917, 1-(6-METHYL-3-PYRIDYL)ETHYLAMINE, A,6-DIMETHYL-3-PYRIDINEMETHANAMINE, KB-215565, 1-(6-METHYLPYRIDIN-3-YL)ETHAN-1-AMINE, 3-PYRIDINEMETHANAMINE, ALPHA,6-DIMETHYL-, A844189

Molecular Formula: C8H12N2Molecular Weight: 136.194280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GLTIIUKSLNSXKM-UHFFFAOYSA-N

• 1-(phenylmethyl)- 3-Piperidineacetonitrile
IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-dihydro-1,3-thiazol-2-yl)benzamide | CAS Registry Number: 5562-20-9
Synonyms: ZINC02653852, CID2117287, T5266816

Molecular Formula: C19H19N3O3S2Molecular Weight: 401.502460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: CPBZXAOGOISBKS-UHFFFAOYSA-N

• 2,2',2''-[1,3,5-benzenetriyltris(oxy)]tris-Acetic acid
IUPAC Name: 2-[3,5-bis(carboxymethoxy)phenoxy]acetic acid | CAS Registry Number: 215162-34-8
Synonyms: RW2694, AK141935, 2,2',2''-(Benzene-1,3,5-triyltris(oxy))triacetic acid

Molecular Formula: C12H12O9Molecular Weight: 300.218280 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: OMPLWOKOQNOVCD-UHFFFAOYSA-N

• 2,2-DiethoxyAcetamide
IUPAC Name: 2,2-diethoxyacetamide | CAS Registry Number: 61189-99-9
Synonyms: 2,2-Diethoxyacetamide, Glyoxylic amide diethyl acetal, 370452_ALDRICH, NSC363000, EINECS 262-647-7, CID100765, ZINC00388476, LT03332310

Molecular Formula: C6H13NO3Molecular Weight: 147.172320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DSKGWFQMJHBHRT-UHFFFAOYSA-N

• 2,2-Diethoxyethanethioamide
IUPAC Name: 2,2-diethoxyethanethioamide | CAS Registry Number: 73956-15-7
Synonyms: 2,2-diethoxyethanethioamide, SBB056474, AG-G-93324, ZINC04287560, AC1MDRRW, 2,2-Diethoxythioacetamide, Ethanethioamide,2,2-diethoxy-, CTK5D8999, MolPort-000-145-153, ACT03871, RW2672, 1-amino-2,2-diethoxyethane-1-thione, AKOS006237671, BP-20426, KB-67113, A9513, FT-0660034, I09-1350

Molecular Formula: C6H13NO2SMolecular Weight: 163.237920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MQSDGAKLSVITHP-UHFFFAOYSA-N

• 2,3-Dihydro-1,4-benzothiazepin-5(4H)-one
IUPAC Name: 3,4-dihydro-2H-1,4-benzothiazepin-5-one | CAS Registry Number: 14944-00-4
Synonyms: 3,4-Dihydrobenzo[f][1,4]thiazepin-5(2H)-one, 2,3,4,5-TETRAHYDRO-1,4-BENZOTHIAZEPIN-5-ONE, AC1NQQLD, SureCN5850195, CTK0E8717, MolPort-001-738-549, RW2678, MCULE-5378037418, QC-8963, AK141928, KB-21778, 3,4-dihydro-2H-1,4-benzothiazepin-5-one, 3,4-dihydro-1,4-benzothiazepin-5(2h)-one, 1,4-Benzothiazepin-5(2H)-one, 3,4-dihydro-

Molecular Formula: C9H9NOSMolecular Weight: 179.238860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FSBGEQZKWJSKIW-UHFFFAOYSA-N

• 2,3-Dimethyl-4-methoxybenzoic acid
IUPAC Name: 4-methoxy-2,3-dimethylbenzoic acid | CAS Registry Number: 5628-61-5
Synonyms: 4-methoxy-2,3-dimethylbenzoic acid, SureCN732725, AGN-PC-00MKW0, CTK5A4918, MolPort-003-855-279, RW2692, SBB017705, AKOS006295759, AG-L-23652, Benzoic acid, 4-methoxy-2,3-dimethyl-, AK141933, KB-92568, KB-204772, FT-0682141, I01-13649

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IPCTTXWQWCZEOE-UHFFFAOYSA-N

• 2,4-Dichloro-5-methylpyrimidine
IUPAC Name: 2,4-dichloro-5-methylpyrimidine | CAS Registry Number: 1780-31-0
Synonyms: D66182_ALDRICH, 5-Methyl-2,4-dichloropyrimidine, NSC37532, Pyrimidine, 2,4-dichloro-5-methyl-, CID74508, EINECS 217-227-8, NSC 37532, InChI=1/C5H4Cl2N2/c1-3-2-8-5(7)9-4(3)6/h2H,1H

Molecular Formula: C5H4Cl2N2Molecular Weight: 163.004660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DQXNTSXKIUZJJS-UHFFFAOYSA-N

• 2-(4-Phenyl-1,3-Thiazol-2-Yl)Acetonitrile
IUPAC Name: 2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile | CAS Registry Number: 41381-89-9
Synonyms: Maybridge1_006883, CID704539, ZINC00088487, BAS 01020743, (4-Phenyl-thiazol-2-yl)-acetonitrile, BBV-097176, SR-01000632051-1

Molecular Formula: C11H8N2SMolecular Weight: 200.259620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SOFCSIBVJROWGI-UHFFFAOYSA-N

• 2-[2-(4-Piperidinyl)ethyl]pyridine
IUPAC Name: 2-(2-piperidin-4-ylethyl)pyridine | CAS Registry Number: 1001754-72-8
Synonyms: 2-(2-(Piperidin-4-yl)ethyl)pyridine, AC1Q28Q8, MolPort-019-878-605, ANW-65770, RW2626, 2-[2-(4-piperidinyl)ethyl]pyridine, 2-(2-Piperidin-4-Yl-Ethyl)Pyridine, AKOS006304988, 2-[2-(4-piperidinyl)ethyl]-Pyridine, QC-8931, AK-88993, KB-67937

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

InChIKey: DWUJDNHHQKEOPR-UHFFFAOYSA-N

• 2-Bromo-1-(4-Morpholinyl)Ethanone
IUPAC Name: 2-bromo-1-morpholin-4-ylethanone | CAS Registry Number: 40299-87-4
Synonyms: 4-(BROMOACETYL)MORPHOLINE, 2-Bromo-1-morpholinoethanone, 4-(2-Bromoacetyl)morpholine, 2-Bromo-1-(morpholin-4-yl)ethan-1-one, 2-Bromo-1-Morpholin-4-Yl-Ethanone, 2-bromo-1-(morpholin-4-yl)ethanone, SBB051005, MORPHOLINE, 4-(BROMOACETYL)-, AG-F-42842, 2-bromo-1-(4-morpholinyl)-1-ethanone, 2-bromo-1-morpholin-4-ylethan-1-one, SureCN311608, AC1Q27GT, ARONIS012378, AGN-PC-00027Y, CTK4I2844, MolPort-002-786-333, ANW-58092, RW2674, STL066928

Molecular Formula: C6H10BrNO2Molecular Weight: 208.053100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LLLQAMNGYJQUKK-UHFFFAOYSA-N

• 2-CHLORO-5,6-DIMETHYL-3-PYRIDINECARBONITRILE
IUPAC Name: 2-chloro-5,6-dimethylpyridine-3-carbonitrile | CAS Registry Number: 65176-93-4
Synonyms: 3-Pyridinecarbonitrile, 2-chloro-5,6-dimethyl-, AGN-PC-00JYMA, Ambcb9198643, CTK1J8413, RW2709, ZINC33359745, AKOS010924199, AG-G-45163, MCULE-3624785055, 2-Chloro-3-cyano-5,6-dimethylpyridine, KB-229807, FT-0664649

Molecular Formula: C8H7ClN2Molecular Weight: 166.607580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BYVPJDZJIHOUHA-UHFFFAOYSA-N

• 2-Chloro-6-methylnicotinic acid
IUPAC Name: 2-chloro-6-methylpyridine-3-carboxylic acid | CAS Registry Number: 30529-70-5
Synonyms: 357847_ALDRICH, ALBB-005466, EINECS 250-229-7, SBB003843, 2-Chloro-6-methyl-3-pyridinecarboxylic acid, 3-Pyridinecarboxylic acid, 2-chloro-6-methyl-, InChI=1/C7H6ClNO2/c1-4-2-3-5(7(10)11)6(8)9-4/h2-3H,1H3,(H,10,11

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ACQXHCHKMFYDPM-UHFFFAOYSA-N

• 2-ethoxy-5-(4-pyrimidinyl)Benzoic acid
IUPAC Name: 2-ethoxy-5-pyrimidin-4-ylbenzoic acid | CAS Registry Number: 1359704-34-9
Synonyms: 2-ETHOXY-5-(PYRIMIDIN-4-YL)BENZOIC ACID, RW2648, QC-8940, AK141921

Molecular Formula: C13H12N2O3Molecular Weight: 244.245980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: QLWXLZNVQSSEIQ-UHFFFAOYSA-N

• 2-fluoro-4-methoxy-Benzenepropanoic acid
IUPAC Name: 3-(2-fluoro-4-methoxyphenyl)propanoic acid | CAS Registry Number: 852181-15-8
Synonyms: 3-(2-Fluoro-4-methoxyphenyl)propanoic acid, SureCN2723938, CTK8C3946, KLEYADLSRYOXMC-UHFFFAOYSA-, ANW-70848, RW2702, AKOS016007775, QC-8941, AK104939, AM804409, KB-232658, InChI=1/C10H11FO3/c1-14-8-4-2-7(9(11)6-8)3-5-10(12)13/h2,4,6H,3,5H2,1H3,(H,12,13)

Molecular Formula: C10H11FO3Molecular Weight: 198.190943 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: KLEYADLSRYOXMC-UHFFFAOYSA-N

• 2-Furancarboxylic acid,5-(1,1-dimethylethyl)-, methyl ester
IUPAC Name: methyl 5-tert-butylfuran-2-carboxylate | CAS Registry Number: 59907-23-2
Synonyms: methyl 5-tert-butylfuran-2-carboxylate, methyl 5-(tert-butyl)furan-2-carboxylate, NSC69079, AC1L5GXF, AC1Q5ZEZ, SureCN3229079, NCIOpen2_000609, CTK5B0680, MolPort-019-857-843, AR-1J5593, NSC-69079, RW2724, AKOS015998412, AG-J-05701, MCULE-3207377608, AK141946, ST099122, 2-Furoicacid, 5-tert-butyl-, methyl ester (7CI); Methyl5-tert-butylfuran-2-carboxylate; NSC 69079

Molecular Formula: C10H14O3Molecular Weight: 182.216360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UBRPDRSWIRZWQG-UHFFFAOYSA-N

• 2-Hydroxy-6-methylnicotinic acid
IUPAC Name: 6-methyl-2-oxo-1H-pyridine-3-carboxylic acid | CAS Registry Number: 38116-61-9
Synonyms: Maybridge3_006033, Oprea1_731245, H43008_ALDRICH, 6-Methyl-3-carboxy-2-pyridone, 2-Hydroxy-6-methylpyridine-3-carboxylic acid, NSC10728, EINECS 253-784-3, SBB004049, IDI1_017420, SB 01990, 6-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid, 3-Pyridinecarboxylic acid, 1,2-dihydro-6-methyl-2-oxo-, InChI=1/C7H7NO3/c1-4-2-3-5(7(10)11)6(9)8-4/h2-3H,1H3,(H,8,9)(H,10,11

Molecular Formula: C7H7NO3Molecular Weight: 153.135380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XRIHTJYXIHOBDQ-UHFFFAOYSA-N

• 2-Methyl-1H-Benzimidazol-6-Amine
IUPAC Name: 2-methyl-3H-benzimidazol-5-amine | CAS Registry Number: 29043-48-9
Synonyms: 2-Methyl-1H-benzimidazol-5-amine, Oprea1_595207, ZERO/005255, MolPort-000-160-333, MolPort-001-792-674, NSC240761, ALBB-005602, CID315500, STK394271, ZINC00368808, 1H-Benzimidazol-5-amine, 2-methyl-, 2-Methyl-3H-benzoimidazol-5-ylamine, GL-0784, BAS 03420893, 23291-87-4

Molecular Formula: C8H9N3Molecular Weight: 147.177160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UJYKXBDYOPPOCY-UHFFFAOYSA-N

• 2-methyl-5, 6, 7, 8-tetrahydro-3H-pyrido[3,4-d]pyrimidin-4-one
IUPAC Name: 2-methyl-5,6,7,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-4-one | CAS Registry Number: 62259-95-4
Synonyms: 2-methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(3H)-one, RW2644, QC-8947, AK136796, KB-25422

Molecular Formula: C8H11N3OMolecular Weight: 165.192440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YYZKKLJMPSCJHD-UHFFFAOYSA-N

• 2-phenyl-Pyrazolo[1,5-a]pyrimidin-7-ol
IUPAC Name: 2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one | CAS Registry Number: 90019-56-0
Synonyms: 2-Phenylpyrazolo[1,5-a]pyrimidin-7-ol, 77493-73-3, SureCN7715678, CHEMBL49885, CTK2G6349, CTK3I5397, RW2660, QC-8949, AK141925, KB-232087, Pyrazolo[1,5-a]pyrimidin-7-ol, 2-phenyl-, 2-Phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one, Pyrazolo[1,5-a]pyrimidin-7(4H)-one, 2-phenyl-

Molecular Formula: C12H9N3OMolecular Weight: 211.219360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LCIWNFJRZJKIJM-UHFFFAOYSA-N

• 2-Piperazin-Yl-4-(trifluoromethyl)pyrimidine
IUPAC Name: 2-piperazin-1-yl-4-(trifluoromethyl)pyrimidine | CAS Registry Number: 179756-91-3
Synonyms: 2-Piperazin-yl-4-(trifluoromethyl)pyrimidine, 2-(piperazin-1-yl)-4-(trifluoromethyl)pyrimidine, 1-[4-(Trifluoromethyl)pyrimid-2-yl]piperazine, 1-(4-Trifluoromethylpyrimidin-2-yl)piperazine, 2-piperazin-1-yl-4-(trifluoromethyl)pyrimidine, SBB022824, AG-E-30035, 1-(4-trifluoromethyl-pyrimidin-2-yl)piperazine, 4-(Trifluoromethyl)-2-(piperazin-1-yl)pyrimidine, 2-piperazinyl-4-(trifluoromethyl)pyrimidine, AC1Q4JFX, SureCN230177, AC1MCT28, KSC537G7N, CHEMBL2335157, CTK4D7376, MolPort-000-006-568, ACT03744, ANW-56587, RW2634

Molecular Formula: C9H11F3N4Molecular Weight: 232.205650 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: WBJVPAABGFBMJQ-UHFFFAOYSA-N

• 3,4-dihydro-2H-benzo[b][1,4]oxazin-7-ol
IUPAC Name: 3,4-dihydro-2H-1,4-benzoxazin-7-ol | CAS Registry Number: 104535-37-7
Synonyms: 3,4-dihydro-2H-1,4-benzoxazin-7-ol, SureCN2746377, CTK8G4896, RW2718, AKOS006307395, MB09266, QC-8964, 2H-1,4-Benzoxazin-7-ol,3,4-dihydro, AK141943, KB-234018, AM20020138, FT-0660810, 2H-1,4-BENZOXAZIN-7-OL, 3,4-DIHYDRO-, 3,4-DIHYDRO-2H-BENZO[1,4]OXAZIN-7-OL

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

InChIKey: OMQHSWHJETUHBX-UHFFFAOYSA-N

• 3-(1-methyl-1H-imidazol-2-yl)-3-oxopropanenitrile
IUPAC Name: 3-(1-methylimidazol-2-yl)-3-oxopropanenitrile | CAS Registry Number: 118431-92-8
Synonyms: 3-(1-Methyl-1H-imidazol-2-yl)-3-oxopropanenitrile, AGN-PC-00O9EI, SureCN10445299, RW2658, MCULE-1436024056, QC-8953, AK141924, 3-(1-methylimidazol-2-yl)-3-oxopropanenitrile

Molecular Formula: C7H7N3OMolecular Weight: 149.149980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AFFSAWQIHUVQLU-UHFFFAOYSA-N

• 3-(4-fluorophenyl)-8-Azabicyclo[3.2.1]octane
IUPAC Name: 3-(4-fluorophenyl)-8-azabicyclo[3.2.1]octane | CAS Registry Number: 291289-52-6
Synonyms: 3-(4-Fluorophenyl)-8-azabicyclo[3.2.1]octane, SureCN1206040, RW2700, QC-8956, AK141937

Molecular Formula: C13H16FNMolecular Weight: 205.271243 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XNXGLTJWOZMRNZ-UHFFFAOYSA-N

• 3-(4-Piperidinyl)-2-Oxazolidinone
IUPAC Name: 3-piperidin-4-yl-1,3-oxazolidin-2-one | CAS Registry Number: 164518-96-1
Synonyms: 3-(PIPERIDIN-4-YL)OXAZOLIDIN-2-ONE, 3-(4-piperidinyl)-2-Oxazolidinone, AGN-PC-00KORI, SureCN1662903, CTK4D1835, MolPort-012-800-357, ANW-65768, RW2623, AKOS010604324, 2-Oxazolidinone, 3-(4-piperidinyl)-, AG-I-03134, QC-7747, AK-88995, KB-69877

Molecular Formula: C8H14N2O2Molecular Weight: 170.208960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SQGSXVBOGZMGFV-UHFFFAOYSA-N

• 3-(4-Piperidyl)propionic Acid
IUPAC Name: 3-piperidin-4-ylpropanoic acid | CAS Registry Number: 1822-32-8
Synonyms: 3-Piperidin-4-yl-propionic acid, 3-piperidin-4-ylpropanoic acid, 3-(Piperidin-4-yl)propanoicacid, 3-(piperidin-4-yl)propanoic acid, SBB066836, 3-(4-piperidyl)propanoic Acid, PubChem19136, 4-Piperidinepropanoicacid, 4-Piperidinepropanoic acid, SureCN954535, AC1Q75BP, AC1LU518, CHEMBL110858, CTK0H4189, 3-Piperidin-4-yl-propanoic acid, 3-Piperidine-4-yl-propionic acid, CHEBI:283107, MolPort-000-006-000, ANW-75292, RW2627

Molecular Formula: C8H15NO2Molecular Weight: 157.210200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AUYQMCCWFNSFGV-UHFFFAOYSA-N

• 3-Acetylbenzonitrile
IUPAC Name: 3-acetylbenzonitrile | CAS Registry Number: 6136-68-1
Synonyms: m-Cyanoacetophenone, 3'-Cyanoacetophenone, 292214_ALDRICH, EINECS 228-110-6, NSC210360, ZINC01745805, InChI=1/C9H7NO/c1-7(11)9-4-2-3-8(5-9)6-10/h2-5H,1H

Molecular Formula: C9H7NOMolecular Weight: 145.157980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SBCFGFDAZCTSRH-UHFFFAOYSA-N

• 3-Amino-3-(3-pyridyl)propionic acid
IUPAC Name: 3-amino-3-pyridin-3-ylpropanoic acid | CAS Registry Number: 62247-21-6
Synonyms: 3-amino-3-(pyridin-3-yl)propanoic acid, (RS)-3-Amino-3-(3-Pyridyl)-Propionic Acid, 3-amino-3-pyridin-3-ylpropanoic acid, 3-Amino-3-(3'-pyridyl)propionic acid, 3-Amino-3-pyridin-3-yl-propionic acid, 3-Amino-3-(3-pyridyl)propionicacid, AG-G-28416, 3-amino-3-(3-pyridinyl)propanoic acid, DL-3-Amino-3-(3'-pyridyl)-propionic acid, 3-azanyl-3-pyridin-3-yl-propanoic acid, 3-Pyridinepropanoicacid, b-amino-, (bS)-, ACMC-20dpuq, PubChem13900, ACMC-1C5QQ, SureCN157097, AC1MTR69, Oprea1_753917, KSC497A1R, RARECHEM AK HC S246, STOCK1N-13575

Molecular Formula: C8H10N2O2Molecular Weight: 166.177200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QOTCEJINJFHMLO-UHFFFAOYSA-N

• 3-Aminomethyl piperidine
IUPAC Name: piperidin-3-ylmethanamine | CAS Registry Number: 23099-21-0
Synonyms: 3-Aminomethyl-piperidine, Piperidine-3-methylamine, EINECS 245-428-0, TL8001925

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

InChIKey: IPOVLZSJBYKHHU-UHFFFAOYSA-N


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