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Shanghai APIs Chemical Co., Ltd.

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Profile: Shanghai APIs Chemical Co., Ltd. is specializes in manufacturer of API chemicals to various chemical induistries.

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• 6,7-Dihydro-5H-pyrrolo[3,4-b]pyridine hydrochloride
IUPAC Name: 6,7-dihydro-5H-pyrrolo[3,4-b]pyridine;dihydrochloride | CAS Registry Number: 147740-02-1
Synonyms: 6,7-Dihydro-5H-pyrrolo[3,4-b]pyridine dihydrochloride, 6,7-Dihydro-5H-pyrrolo[3,4-b]pyridine 2HCl, 6,7-dihydro-5H-Pyrrolo[3,4-b]pyridinedihydrochloride, PubChem18111, ACMC-1C7FX, SureCN4573663, CTK8B5875, MolPort-000-003-150, BH350, ACT08866, ANW-50778, FC0257, RW3910, SC3341, AKOS015845601, AM84443, OR30672, AK-27514, BR-27514, KB-44484

Molecular Formula: C7H10Cl2N2Molecular Weight: 193.073700 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: FZBCVKVGLQRBHY-UHFFFAOYSA-N

• 3-Biphenylmethanol
IUPAC Name: (3-phenylphenyl)methanol | CAS Registry Number: 69605-90-9
Synonyms: [1,1'-Biphenyl]-3-ylmethanol, (3-phenylphenyl)methanol, [1,1'-Biphenyl]-3-methanol, AG-G-71147, biphenyl-3-methanol, AGN-PC-0CUJQB, AC1LCNV5, SureCN249824, KSC352M6R, CHEMBL330965, 3-PHENYL BENZYL ALCOHOL, CTK2F2668, MolPort-003-987-147, SBB068684, ZINC21299940, AKOS006290018, MCULE-4056858813, AK112097, KB-180954, TL8004885

Molecular Formula: C13H12OMolecular Weight: 184.233780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WGUZZTGZDPJWSG-UHFFFAOYSA-N

• 3-[(2S,4S)-4-Mercaptopyrrolidine-2-carboxamido]benzoic acid hydrochloride
IUPAC Name: 3-[[(2S,4S)-4-sulfanylpyrrolidine-2-carbonyl]amino]benzoic acid;hydrochloride | CAS Registry Number: 219909-83-8
Synonyms: UNII-P024OE4203, 3-((2S,4S)-4-Mercaptopyrrolidine-2-carboxamido)benzoic acid hydrochloride, 3-[(2S,4S)-4-mercaptopyrrolidine-2-carboxamido]benzoic acid hydrochloride, MolPort-003-987-580, AKOS016008894, P024OE4203, AK110751, KB-232322, TL8006304, 3-(((2S,4S)-4-Sulfanylpyrrolidine-2-carbonyl)amino)benzoic acid hydrochloride, 3-[[[(2s,4s)-4-mercapto-2-pyrrolidinyl]carbonyl]amino]-benzoic acid, monohydrochloride, Benzoic acid, 3-((((2S,4S)-4-mercapto-2-pyrrolidinyl)carbonyl)amino)-, hydrochloride (1:1)

Molecular Formula: C12H15ClN2O3SMolecular Weight: 302.777100 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 5

InChIKey: DDRIIBZWSJDJQQ-IYPAPVHQSA-N

• 2-(Dicyclohexylphosphino)-2',4',6'-triisopropylbiphenyl
IUPAC Name: dicyclohexyl-[2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane | CAS Registry Number: 564483-18-7
Synonyms: X-Phos, XPhos, 2-(Dicyclohexylphosphino)-2',4',6'-tri-i-propyl-1,1'-biphenyl, CHEMDOSE(TM), X-PHOS, 2-(dicyclohexylphosphino)-2,4,6-tri-i-propyl-1,1-biphenyl, 2-Dicyclohexylphosphino-2',4',6'-triisopropylbiphenyl, AG-F-98226, dicyclohexyl[2-(2,4,6-triisopropylphenyl)phenyl]phosphane, 2-dicyclohexylphosphino-2',4',6'-tri-isopropyl-1,1'-biphenyl, 2-DICYCLOHEXYLPHOSPHINO-2,4,6-TRIISOPROPYLBIPHENYL, DICYCLOHEXYL(2',4',6'-TRIISOPROPYLBIPHENYL-2-YL)PHOSPHINE, DICYCLOHEXYL([2-[2,4,6-TRIS(PROPAN-2-YL)PHENYL]PHENYL])PHOSPHANE, PHOSPHINE, DICYCLOHEXYL[2',4',6'-TRIS(1-METHYLETHYL)[1,1'-BIPHENYL]-2-YL]-, 2-dicyclohexylphosphino-2',4',6'-triisopropyl-1,1'-biphenyl, PubChem22458, ACMC-20a0um, SureCN9618, X-Phos, ChemDose(R) tablets, 638064_ALDRICH, 685151_ALDRICH

Molecular Formula: C33H49PMolecular Weight: 476.715922 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UGOMMVLRQDMAQQ-UHFFFAOYSA-N

• 2-Diphenylphosphino-2'-(N,N-dimethylamino)biphenyl
IUPAC Name: 2-(2-diphenylphosphanylphenyl)-N,N-dimethylaniline | CAS Registry Number: 240417-00-9
Synonyms: 2-Dimethylamino-2'-(diphenylphosphino)biphenyl, 2-Diphenylphosphino-2`-dimethylaminobiphenyl, PHDAVEPHOS, PubChem9101, AC1MC2A2, MolPort-003-984-568, ANW-75366, RW2172, AKOS015840665, AC-4979, AG-E-70919, GC10114, RL02764, AK-49594, KB-68594, FT-0658607, ST51055014, A25282, 2-(2-diphenylphosphanylphenyl)-N,N-dimethylaniline, 2-DIPHENYLPHOSPHINO-2'-DIMETHYLAMINOBIPHENYL

Molecular Formula: C26H24NPMolecular Weight: 381.449222 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JGFXUYLYPITYGR-UHFFFAOYSA-N

• 3-Piperidinamine, N,4-dimethyl-1-(phenylmethyl)-, (3R,4R)-
IUPAC Name: (3R,4R)-1-benzyl-N,4-dimethylpiperidin-3-amine | CAS Registry Number: 477600-70-7
Synonyms: (3R,4R)-1-BENZYL-N,4-DIMETHYLPIPERIDIN-3-AMINE, AG-F-62413, cis-1-Benzyl-N,4-dimethylpiperidin-3-amine, SureCN352022, CTK4J0251, MolPort-000-140-288, QC-53, ANW-52419, AKOS007930642, AKOS015919918, LS30281, PB32723, AK-29283, BR-29283, KB-01608, AB1006556, FT-0648188, W6439, A25786, B-1329

Molecular Formula: C14H22N2Molecular Weight: 218.337880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NVKDDQBZODSEIN-OCCSQVGLSA-N

• 4-Pentenoic acid, 5-chloro-2-(1-methylethyl)-, methyl ester, (2S,4E)-
IUPAC Name: methyl (2S)-5-chloro-2-propan-2-ylpent-4-enoate | CAS Registry Number: 387353-77-7
Synonyms: (S,E)-Methyl 5-chloro-2-isopropylpent-4-enoate, CTK8B9237, ANW-62251

Molecular Formula: C9H15ClO2Molecular Weight: 190.667200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BHFJTVFRXXWPLV-QMMMGPOBSA-N

• (S)-3-Aminopyrrolidine
IUPAC Name: (3S)-pyrrolidin-3-amine | CAS Registry Number: 128345-57-3
Synonyms: (3S)-(-)-3-Aminopyrrolidine, (S)-pyrrolidin-3-amine, (S)-(-)-3-Aminopyrrolidine, AG-D-58481, PubChem5729, (3S)-3-Aminopyrrolidine, (3S)-pyrrolidin-3-amine, SureCN336177, 3-Pyrrolidinamine,(3S)-, AC1LU30H, 540803_ALDRICH, CTK4B5913, MolPort-000-000-473, ANW-19062, AKOS006238850, AKOS015854202, AK109063, KB-01633, FT-0081989, A44020

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

InChIKey: NGXSWUFDCSEIOO-BYPYZUCNSA-N

• 4-(tert-Butoxycarbonylaminomethyl)piperidine
IUPAC Name: tert-butyl N-(pyridin-4-ylmethyl)carbamate | CAS Registry Number: 135632-53-0
Synonyms: N-Boc-4-aminomethylpyridine, 649767_ALDRICH, ZINC00128559, CID1512532

Molecular Formula: C11H16N2O2Molecular Weight: 208.256940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KXCFJDZVQLRYSI-UHFFFAOYSA-N

• 2-BOC-Hexahydro-Pyrrolo[3,4-C]Pyrrole
IUPAC Name: tert-butyl 3,3a,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole-2-carboxylate | CAS Registry Number: 141449-85-6
Synonyms: AS0037, 2-Boc-Hexahydro-pyrrolo[3,4-C]pyrrole

Molecular Formula: C11H20N2O2Molecular Weight: 212.288700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FYUVLZRRIRGSTE-UHFFFAOYSA-N

• 6-Methoxyindole
IUPAC Name: 6-methoxy-1H-indole | CAS Registry Number: 3189-13-7
Synonyms: Indole, 6-methoxy-, 6-Methoxy-1H-indole, 1H-Indole, 6-methoxy-, NCIOpen2_001305, 1H-Indol-6-yl methyl ether, MLS000689267, 139858_ALDRICH, NSC92517, EINECS 221-689-6, ZINC00337544, LA-0711, M2150G1, SMR000311065, TL8002430, M-3460, AQ-776/40228276

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

InChIKey: QJRWYBIKLXNYLF-UHFFFAOYSA-N

• 2-Hydroxy-5-trifluoromethylpyridine
IUPAC Name: 5-(trifluoromethyl)-1H-pyridin-2-one | CAS Registry Number: 33252-63-0
Synonyms: Maybridge1_006426, 2H-5TFMP, TPC-PY072, 442801_ALDRICH, 5-(Trifluoromethyl)-2-pyridinol, 2-Hydroxy-5-(trifluoromethyl)pyridine, ZINC00078089, 2-Hydroxy-5-Trifluoromethyl Pyridine, 5-(Trifluoromethyl)-2(1H)-pyridinone, 2(1H)-Pyridinone, 5-(trifluoromethyl)-, ST5407040, SR-01000639040-1

Molecular Formula: C6H4F3NOMolecular Weight: 163.097270 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: BYRJSCNPUHYZQE-UHFFFAOYSA-N

• 6-Bromo-3-Nitroquinolin-4-Ol
IUPAC Name: 6-bromo-3-nitro-1H-quinolin-4-one | CAS Registry Number: 853908-50-6
Synonyms: 6-Bromo-3-nitro-4-quinolinol, 6-bromo-3-nitroquinolin-4-ol, 6-bromo-3-nitro-quinolin-4-ol, 4-Quinolinol, 6-bromo-3-nitro-, AG-H-43351, PubChem19389, ACMC-209q5r, SureCN358629, 6-Bromo-3-nitroquinolin-4-ol;, CTK3E7443, HT721, ACT01928, 6-Bromo-4-hydroxy-3-nitroquinoline, ANW-38173, WTI-11320, ZINC16697272, 6-bromo-3-nitro-1H-quinolin-4-one, AKOS005259541, AC-4430, PB14737

Molecular Formula: C9H5BrN2O3Molecular Weight: 269.051600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: AMKJVYOALDEARM-UHFFFAOYSA-N

• 2,7-Diazaspiro[4.4]nonane-2-Carboxylic Acid, 1,1-Dimethylethyl Ester
IUPAC Name: tert-butyl 3,8-diazaspiro[4.4]nonane-3-carboxylate | CAS Registry Number: 236406-49-8
Synonyms: AmbTiD57138, D57138, 2,7-Diaza-spiro[4.4]nonane-2-carboxylic acid tert-butyl ester

Molecular Formula: C12H22N2O2Molecular Weight: 226.315280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HPPARSNAMZJAPZ-UHFFFAOYSA-N

• 5h-Pyrrolo[3,4-B]pyrazine, 6,7-Dihydro-
IUPAC Name: 6,7-dihydro-5H-pyrrolo[3,4-b]pyrazine | CAS Registry Number: 871792-60-8
Synonyms: 6,7-dihydro-5H-pyrrolo[3,4-b]pyrazine, SureCN846820, SureCN6360031, MolPort-020-014-344, AKOS006343581, AB65657, AK-37730, KB-44482, 5H,6H,7H-PYRROLO[3,4-B]PYRAZINE, 6,7-DIHYDRO-PYRROLO[3,4-B]PYRAZINE, A10378, 5H-PYRROLO[3,4-B]PYRAZINE, 6,7-DIHYDRO-, S14-2040

Molecular Formula: C6H7N3Molecular Weight: 121.139880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GSIQLKOFXMCKNK-UHFFFAOYSA-N

• 1-2(-Hydroxy Ethyl) Piperazine
IUPAC Name: 2-piperazin-1-ylethanol | CAS Registry Number: 103-76-4
Synonyms: 2-Piperazinoethanol, 1-Piperazinethanol, Hydroxyethylpiperazine, 1-PIPERAZINEETHANOL, 2-Hydroxyethylpiperazine, 2-Piperazin-1-ylethanol, 1-(2-Hydroxyethyl)piperazine, Piperazine-1-ethanol, 2-(1-Piperazinyl)ethanol, USAF DO-22, N-(2-Hydroxyethyl)piperazine, 4-(2-Hydroxyethyl)piperazine, Ethanol, 2-(1-piperazinyl)-, (.beta.-Hydroxyethyl)piperazine, N-(Hydroxyethyl)piperazine, CCRIS 6687, N-(beta-Hydroxyethyl)piperazine, 1-(beta-Hydroxyethyl)piperazine, H28807_ALDRICH, WLN: T6M DNTJ D2Q

Molecular Formula: C6H14N2OMolecular Weight: 130.188160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WFCSWCVEJLETKA-UHFFFAOYSA-N

• (R)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl [(R)-BINAP]
IUPAC Name: [1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane | CAS Registry Number: 76189-55-4
Synonyms: (R)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, 98327-87-8, 2,2'-BIS(DIPHENYLPHOSPHINO)-1,1'-BINAPHTHYL, (R)-(+)-BINAP, (S)-(-)-BINAP, 76189-56-5, (+/-)-BINAP, rac-BINAP, BINAP, (S)-(-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (+/-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (S)-BINAP, (R)-2,2'-bis(Diphenylphosphino)-1,1'-binaphthyl, (S)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (S)-(-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, (S)-(-)-2,2'-Bis(diphenylphosphosino)-1,1'-binaphthyl, 2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, 2,2'-Bis-diphenylphosphanyl-[1,1']binaphthalenyl, (+/-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, (R)-(+)-2,2'-Bis(diphenylphosphino)-1'1-binaphthyl

Molecular Formula: C44H32P2Molecular Weight: 622.672404 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: MUALRAIOVNYAIW-UHFFFAOYSA-N

• 3,4-Dihydroxyphenylacetic acid methyl ester
IUPAC Name: methyl 2-(3,4-dihydroxyphenyl)acetate | CAS Registry Number: 25379-88-8
Synonyms: Methyl 3,4-dihydroxyphenylacetate, 3,4-Dihydroxyphenylacetic Acid Methyl Ester, ACMC-1CG7A, SureCN3668882, Ambap25379-88-8, CTK4F5606, MolPort-003-986-671, Homoprotocatechuic Acid Methyl Ester, ANW-25713, Catechol-4-acetic Acid Methyl Ester, ZINC02566703, AKOS015900183, AG-E-77650, Pyrocatechol-4-acetic Acid Methyl Ester, KB-202837, TL8002059, 3,4-Dihydroxybenzeneacetic Acid Methyl Ester, D2734, FT-0638516, methyl 2-[3,4-bis(oxidanyl)phenyl]ethanoate

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: UGFILLIGHGZLHE-UHFFFAOYSA-N

• (-)-B-Chlorodiisopinocamphenylborane
IUPAC Name: chloro-[(3R,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-[(3S,4S,5R)-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]borane | CAS Registry Number: 85116-37-6
Synonyms: (-)-B-Chlorodiisopinocampheylborane, RP18118

Molecular Formula: C20H34BClMolecular Weight: 320.747960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: PSEHHVRCDVOTID-GZGCRDQTSA-N

• 5-Fluoro-2-hydroxy-3-nitropyridine
IUPAC Name: 5-fluoro-3-nitro-1H-pyridin-2-one | CAS Registry Number: 136888-20-5
Synonyms: 5-fluoro-2-hydroxy-3-nitropyridine, 5-fluoro-3-nitropyridin-2-ol, 2-Hydroxy-3-nitro-5-fluoropyridine, AG-D-75166, 5-fluoro-3-nitro-1H-pyridin-2-one, PubChem2975, ACMC-1CGZR, SureCN845293, KSC520K3N, 5-Fluoro-3-nitropyridin-2-ol,, CTK4C0536, MolPort-002-041-458, ACT01515, ANW-20193, SBB065484, WTI-10689, ZINC08698153, AKOS005063782, AKOS006282533, AKOS015833758

Molecular Formula: C5H3FN2O3Molecular Weight: 158.087323 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: BLFUHTOZIOQGBU-UHFFFAOYSA-N

• 4-Chloro-7-azaindole
IUPAC Name: 4-chloro-1H-pyrrolo[2,3-b]pyridine | CAS Registry Number: 55052-28-3
Synonyms: 4-CHLORO-7-AZAINDOLE, 4-chloro-1H-pyrrolo[2,3-b]pyridine, AG-F-92201, 1H-PYRROLO[2,3-B]PYRIDINE, 4-CHLORO-, AN-584/43416898, PubChem17277, AC1Q3HXF, AC1Q3HXG, ACMC-1AY8O, SureCN100651, 4-CHLORO-7-AZAINDOL, KSC494A8L, AGN-PC-0084ST, 4-chloropyrrolo[2,3-b]pyridine, CTK3J4085, HIN1337, MolPort-001-758-292, ACN-S002668, ACT03614, 4-chlor-1H-pyrrolo[2,3-b]pyridin

Molecular Formula: C7H5ClN2Molecular Weight: 152.581000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HNTZVGMWXCFCTA-UHFFFAOYSA-N

• 8-Oxa-3-Azabicyclo[3.2.1]octane, Hydrochloride
IUPAC Name: 8-oxa-3-azabicyclo[3.2.1]octane;hydrochloride | CAS Registry Number: 54745-74-3
Synonyms: 8-OXA-3-AZABICYCLO[3.2.1]OCTANE HYDROCHLORIDE, 8-oxa-3-azabicyclo[3,2,1]octane hydrochloride, SBB056375, 8-oxa-3-azabicyclo[3.2.1]octanehydrochloride, SureCN16513, CTK7D1419, MolPort-009-197-067, BH812, ACT09837, ANW-42997, FC0589, 8-oxa-3-azabicyclooctane hydrochloride, AKOS005166896, AG-C-09301, AG-F-90866, QC-1879, RP08591, 8-oxa-3-aza-bicyclo[3.2.1]octane HCl, AK-32096, BR-32096

Molecular Formula: C6H12ClNOMolecular Weight: 149.618580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XADOTNAXKKFKDY-UHFFFAOYSA-N

• 2-(Diphenylphosphino)ethylamine
IUPAC Name: 2-di(phenyl)phosphanylethanamine | CAS Registry Number: 4848-43-5
Synonyms: (2-Aminoethyl)diphenylphosphine, 43162_FLUKA, NSC118384, CID273264

Molecular Formula: C14H16NPMolecular Weight: 229.257301 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: RXEPBCWNHKZECN-UHFFFAOYSA-N

• 4-Pentenoic acid, 5-chloro-2-(1-methylethyl)-, (2S,4E)-
IUPAC Name: (E,2S)-5-chloro-2-propan-2-ylpent-4-enoic acid | CAS Registry Number: 324519-66-6
Synonyms: (S,E)-5-Chloro-2-isopropylpent-4-enoic acid, (2S,4E)-5-Chloro-2-isopropylpent-4-enoic acid, (E)-(S)-5-Chloro-2-isopropyl-pent-4-enoic acid, (2S,4E)-5-CHLORO-2-(1-METHYLETHYL)-4-PENTENOIC ACID, ALISKIREN INTER-3, MolPort-003-985-049, AKOS006309026, AKOS015841546, PB31556, RP23825, AK-88370, KB-212052, AM20090755, X0117, (2S,4E)-5-chloro-2-isopropylpent-4-enoicacid, 5-CHLORO-2-ISOPROPYL-PENT-4-ENOIC ACID, I14-8809, (2S,4E)-4-PENTENOIC ACID,5-CHLORO-2-(1-METHYLETHYL)-

Molecular Formula: C8H13ClO2Molecular Weight: 176.640620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NOPVMHYFCPFLOH-MZTFZBDOSA-N

• 2-Piperidinecarboxylic acid, 1-[2-amino-5-[[imino(nitroamino)methyl]amino]-1-oxopentyl]-4-methyl-, ethyl ester, monohydrochloride, [2R-[1(S*),2a,4b]]-
IUPAC Name: ethyl (2R,4R)-1-[2-amino-5-[[amino(nitramido)methylidene]amino]pentanoyl]-4-methylpiperidine-2-carboxylate;hydrochloride | CAS Registry Number: 74874-08-1
Synonyms: (2R,4R)-Ethyl 1-(2-amino-5-(3-nitroguanidino)pentanoyl)-4-methylpiperidine-2-carboxylate hydrochloride, ETHYL (2R,4R)-1-[2-AMINO-5-[[IMINO(NITROAMINO)METHYL]AMINO]-1-OXOPENTYL]-4-METHYL-2-PIPERIDINECARBOXYLATE HYDROCHLORIDE, CTK2H6931, ANW-71239, AKOS016008022, RL04844, AK104531, KB-206538

Molecular Formula: C15H29ClN6O5Molecular Weight: 408.880960 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: KYMBEZAOVMYAGM-ZZCQIGCDSA-N

• (S)-(-)-3-Butyn-2-Ol
IUPAC Name: (2S)-but-3-yn-2-ol | CAS Registry Number: 2914-69-4
Synonyms: 1-Methylpropargyl alcohol, 464007_ALDRICH, (S)-(-)-3-Butyn-2-ol, ZINC01756137, CID6995470

Molecular Formula: C4H6OMolecular Weight: 70.089840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GKPOMITUDGXOSB-BYPYZUCNSA-N

• 1-Boc-Octahydropyrrolo[3,4-B]pyridine
IUPAC Name: tert-butyl (4aR,7aS)-2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridin-6-ium-1-carboxylate | CAS Registry Number: 159877-36-8
Synonyms: ZINC04203951

Molecular Formula: C12H23N2O2+Molecular Weight: 227.323220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LGEWGFOMLJQHLL-NXEZZACHSA-O

• 5-Boc-Octahydro-Pyrrolo[3,4-C]pyridine
IUPAC Name: tert-butyl (3aS,7aR)-1,2,3,3a,4,6,7,7a-octahydropyrrolo[3,4-c]pyridin-2-ium-5-carboxylate | CAS Registry Number: 351370-99-5
Synonyms: ZINC04203955

Molecular Formula: C12H23N2O2+Molecular Weight: 227.323220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LRTPRHCNWAEZBN-UWVGGRQHSA-O

• 4,6-dichloro-2-propylthiopyrimidine-5-amine
IUPAC Name: 4,6-dichloro-2-propylsulfanylpyrimidin-5-amine | CAS Registry Number: 145783-15-9
Synonyms: 4,6-dichloro-2-(propylthio)pyrimidin-5-amine, 5-PYRIMIDINAMINE, 4,6-DICHLORO-2-(PROPYLTHIO)-, AGN-PC-0092PH, CTK8B6238, AMX10103, ANW-53050, AKOS015851287, EX-7178, PB24255, QC-1823, RP28320, AK-78904, BP-20662, KB-35732, AM20090748, FT-0686722, X4776, 4,6-DICHLORO-5-AMINO-2-PROPYLTHIOPYRIMIDINE, 4,6-DICHLORO-2-(PROPYLTHIO)-5-PYRIMIDINAMINE, 4,6-DICHLORO-2-(PROPYLSULFANYL)PYRIMIDIN-5-AMINE

Molecular Formula: C7H9Cl2N3SMolecular Weight: 238.137460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CJJLJBFJNXMANZ-UHFFFAOYSA-N

• 2-HYDROXYMETHYLOXETANE
IUPAC Name: oxetan-2-ylmethanol | CAS Registry Number: 61266-70-4
Synonyms: 2-Hydroxymethyloxetane, Oxetan-2-ylmethanol, 2-Oxetanemethanol, 2,4-Epoxybutanol, 2-oxetanylmethanol, SureCN5365, ACMC-1B3CT, CTK5B2963, MolPort-003-886-363, ANW-33743, AKOS015856507, AG-G-23085, PB20918, RP08270, AK-64713, AM807004, BB 0261645, FT-0648958, FT-0686090, H0773

Molecular Formula: C4H8O2Molecular Weight: 88.105120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PQZJTHGEFIQMCO-UHFFFAOYSA-N

• 2-Azetidinecarboxylic acid methyl ester
IUPAC Name: methyl azetidine-2-carboxylate | CAS Registry Number: 134419-57-1
Synonyms: methyl azetidine-2-carboxylate, METHYL 2-AZETIDINECARBOXYLATE, Azetidine-2-carboxylic acid methyl ester, Azetidine-2-carboxylicacidmethylester, AG-D-70182, 2-Azetidinecarboxylicacid, methyl ester, PubChem23978, ACMC-20a6q2, AGN-PC-00LOF0, SureCN2065284, Methyl2-azetidinecarboxylate;, CTK4B9158, MolPort-000-000-966, ANW-59640, AKOS006277411, MB03946, DL-METHYL 2-AZETIDINECARBOXYLATE, 2-Azetidinecarboxylic acid, methyl ester, AK-44269, KB-47480

Molecular Formula: C5H9NO2Molecular Weight: 115.130460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CHNOQXRIMCFHKZ-UHFFFAOYSA-N

• 1H-PYRROLE-2,3,5-TRICARBOXYLIC ACID,4-METHYL-,3,5-DIETHYL ESTER
IUPAC Name: 3,5-bis(ethoxycarbonyl)-4-methyl-1H-pyrrole-2-carboxylic acid | CAS Registry Number: 37789-75-6
Synonyms: Oprea1_170448, NSC26687, MolPort-003-806-045, CID231108, AI-942/13331751

Molecular Formula: C12H15NO6Molecular Weight: 269.250600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: GLIIUALSMNDSMN-UHFFFAOYSA-N

• 2-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[1,5-A]PYRAZINE,95+%
IUPAC Name: 2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrazine | CAS Registry Number: 681249-56-9
Synonyms: 2-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrazine, SureCN1620961, AKOS006328750, AB52993, AK-24651, I14-17069

Molecular Formula: C6H3F3N4Molecular Weight: 188.110030 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: PODZNIVAQJSKBB-UHFFFAOYSA-N

• 2-(Chloro-Trifluoromethy)Pyridine
IUPAC Name: 2-chloro-3-(trifluoromethyl)pyridine | CAS Registry Number: 65753-47-1
Synonyms: TPC-PY034, 2-Chloro-3-(trifluoromethyl)pyridine, 2-Chloro-3-trifluoromethylpyridine, 469378_ALDRICH, ZINC02584285, CID589833, C240, TL8004664, 3S210998

Molecular Formula: C6H3ClF3NMolecular Weight: 181.542930 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RXATZPCCMYMPME-UHFFFAOYSA-N

• 3-Aminopyrrolidine dihydrochloride
IUPAC Name: [(3R)-pyrrolidin-1-ium-3-yl]azanium | CAS Registry Number: 103831-11-4
Synonyms: ZINC04682891

Molecular Formula: C4H12N2+2Molecular Weight: 88.151480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: NGXSWUFDCSEIOO-SCSAIBSYSA-P

• (R)-3-Aminopyrrolidine
IUPAC Name: (3R)-pyrrolidin-3-amine | CAS Registry Number: 116183-82-5
Synonyms: (R)-pyrrolidin-3-amine, (3R)-(+)-3-Aminopyrrolidine, (3S)-Pyrrolidinamine, (R)-(+)-3-Aminopyrrolidine, AG-D-37492, (R)-3-Aminopyrrolidine dihydrochloride, PubChem5728, (3R)-pyrrolidin-3-amine, SureCN242920, AC1LU30J, 540781_ALDRICH, CTK3J4348, MolPort-000-000-472, ANW-16944, AKOS015854027, AC-13107, AK-80471, BP-12311, BR-80471, KB-03189

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

InChIKey: NGXSWUFDCSEIOO-SCSAIBSYSA-N

• 2-Bromo-6-nitrophenol
IUPAC Name: 2-bromo-6-nitrophenol | CAS Registry Number: 13073-25-1
Synonyms: 643378_ALDRICH, SBB008567, FR-2271, TL8000732

Molecular Formula: C6H4BrNO3Molecular Weight: 218.004860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: VEJSIOPQKQXJAT-UHFFFAOYSA-N

• 2,2,2-trifluoroethoxybenzene
IUPAC Name: 2,2,2-trifluoroethoxybenzene | CAS Registry Number: 17351-95-0
Synonyms: SureCN2280790, 2,2,2-Trifluoroethoxybenzene, (2,2,2-trifluoroethoxy)benzene, CTK0E4287, 2,2,2-trifluoro-1-phenoxyethane, 2-Phenoxy-1,1,1-trifluoroethane, PC6627, SBB089127, Benzene, (2,2,2-trifluoroethoxy)-, AKOS009171712, AG-E-23051

Molecular Formula: C8H7F3OMolecular Weight: 176.135790 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: MFWASTQSJSBGNG-UHFFFAOYSA-N

• (R)-3-Aminomethyl-morpholine-4-carboxylic acid tert-butyl ester
IUPAC Name: tert-butyl (3R)-3-(aminomethyl)morpholine-4-carboxylate | CAS Registry Number: 1187929-33-4
Synonyms: (R)-4-Boc-3-aminomethylmorpholine, (R)-tert-Butyl 3-(aminomethyl)morpholine-4-carboxylate, (R)-3-AMINOMETHYL-MORPHOLINE-4-CARBOXYLIC ACID TERT-BUTYL ESTER, SureCN553583, CTK7D5007, BH064, ACT08808, ANW-59441, FC0078, AKOS015901282, AG-A-07365, AK-37088, KB-03184, (R)-4-Boc-3-aminomethylmorpholine oxalate, KB-210487, I14-15030

Molecular Formula: C10H20N2O3Molecular Weight: 216.277400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IRSSIQNSBCQILH-MRVPVSSYSA-N

• 5-Methoxyindole-2-Carboxylic Acid
IUPAC Name: 5-methoxy-1H-indole-2-carboxylic acid | CAS Registry Number: 4382-54-1
Synonyms: 5-Methoxyindole-2-carboxylic acid, Oprea1_206851, CBDivE_015623, M14951_ALDRICH, 1H-Indole-2-carboxylic acid, 5-methoxy-, 5-Methoxy-2-indolecarboxylic acid, EINECS 224-487-6, NSC 30927, AIDS052335, AIDS-052335, ALBB-000151, NSC30927, SBB003635, INDOLE-2-CARBOXYLIC ACID, 5-METHOXY-, 5-Methoxy-1H-indole-2-carboxylic acid, LS-82721, Acide methoxy-5 indole carboxylique-2 [French], M-3500, 1H-Indole-2-carboxylic acid, 5-methoxy- (9CI)

Molecular Formula: C10H9NO3Molecular Weight: 191.183360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YEBJVSLNUMZXRJ-UHFFFAOYSA-N

• 3,4-Dimethoxyphenylacetic acid
IUPAC Name: 2-(3,4-dimethoxyphenyl)acetic acid | CAS Registry Number: 93-40-3
Synonyms: Homoveratric acid, Benzeneacetic acid, 3,4-dimethoxy-, ChemDiv3_014360, Acetic acid, (3,4-dimethoxyphenyl)-, 3,4-Dimethoxybenzeneacetic acid, 3,4-Dimethoxyphenyl acetic acid, D135909_ALDRICH, (3,4-DIMETHOXYPHENYL)ACETIC ACID, NSC 2753, 53650_FLUKA, EINECS 202-244-5, NSC2753, 3,4-(Dimethoxy)benzeneacetic acid, 3,4-(Dimethoxyphenyl) acetic acid, NSC27897, BRN 1110282, AI3-23354, IDI1_030158, LS-11803, ST5213900

Molecular Formula: C10H12O4Molecular Weight: 196.199880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WUAXWQRULBZETB-UHFFFAOYSA-N

• 2-((3aR,4S,6R,6aS)-6-amino-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yloxy)ethanol L-tataric acid
IUPAC Name: 2-[[(3aR,4S,6R,6aS)-6-amino-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol;(2R,3R,4S,5R)-2,3,4,5-tetrahydroxyhexanedioic acid | CAS Registry Number: 376608-65-0
Synonyms: 2-(((3aR,4S,6R,6aS)-6-Amino-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl)oxy)ethanol (2R,3R,4S,5R)-2,3,4,5-tetrahydroxyhexanedioate, CTK8C0810, AMX10100, ANW-65308, AKOS016005231, KB-219844, 2-((3aR,4S,6R,6aS)-6-amino-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol

Molecular Formula: C16H29NO12Molecular Weight: 427.400960 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 13

InChIKey: BMSGAYRPWQIWHY-AFBFJNDQSA-N

• (±)-Corey lactone diol
IUPAC Name: (3aR,4S,5R,6aS)-5-hydroxy-4-(hydroxymethyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one | CAS Registry Number: 54423-47-1
Synonyms: 32233-40-2, (-)-Corey lactone diol, (-)-Corey lactone, (-)-COREY DIOL (COREY LACTONE), (3aR,4S,5R,6aS)-5-Hydroxy-4-(hydroxymethyl)hexahydro-2H-cyclopenta[b]furan-2-one, ST075172, (3aR,4S,5R,6aS)-(-)-Hexahydro-5-hydroxy-4-(hydroxymethyl)-2H-cyclopenta[b]furan-2-one, (3aR,4S,5R,6aS)-5-hydroxy-4-(hydroxymethyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one, ZINC04261954, AC1MC4YE, (+/-)-Corey lactone diol, SCHEMBL439263, 341576_ALDRICH, MolPort-003-930-593, VYTZWRCSPHQSFX-GBNDHIKLSA-N, AN-278, CC-859, AKOS015900009, AKOS016015263, AC-6090

Molecular Formula: C8H12O4Molecular Weight: 172.178480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: VYTZWRCSPHQSFX-GBNDHIKLSA-N

• ((7S,9AS)-OCTAHYDRO-1H-PYRIDO[1,2-A]PYRAZIN-7-YL)METHANOL
IUPAC Name: [(7S,9aS)-2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazin-7-yl]methanol | CAS Registry Number: 145012-50-6
Synonyms: SureCN3543148, AKOS006285258, AB44671, TRANS-OCTAHYDRO-2H-PYRIDO[1,2-A]PYRAZINE-7-METHANOL, ((7S,9ALPHAS)-OCTAHYDRO-1H-PYRIDO[1,2-A]PYRAZIN-7-YL)-METHANOL

Molecular Formula: C9H18N2OMolecular Weight: 170.252020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IUKDDYAECHPPRM-IUCAKERBSA-N

• 1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
IUPAC Name: 1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid | CAS Registry Number: 868171-67-9
Synonyms: SureCN362582, CTK3C6422, QC-4619, 3-Pyridinecarboxylic acid, 1-(4-fluorophenyl)-1,2-dihydro-2-oxo-

Molecular Formula: C12H8FNO3Molecular Weight: 233.195223 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WPJGHIVGAOVUAT-UHFFFAOYSA-N

• (±) Clopidogrel hydrogen sulfate
IUPAC Name: methyl 2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate;sulfuric acid | CAS Registry Number: 135046-48-9
Synonyms: Clopidogrel hydrogen sulfate, Clopidogrel hydrogensulfate, R-(-)-Clopidogrel Hydrogen Sulfate, SR-25990, PubChem5918, SureCN2307984, AGN-PC-015I9T, CTK8F1338, MolPort-003-983-863, ACN-S002003, ACT04766, ACT06725, AKOS005146215, AC-5597, NCGC00095065-01, NCGC00095065-02, I14-0711, ( inverted exclamation markA) Clopidogrel hydrogensulfate, Methyl (2-chlorophenyl)(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate hydrogen sulfate, methyl (s)-alpha-(2-chlorophenyl)-6,7-dihydrothieno(3,2-c)pyridine-5(4h)-acetate hydrogen sulfate

Molecular Formula: C16H18ClNO6S2Molecular Weight: 419.900220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: FDEODCTUSIWGLK-UHFFFAOYSA-N

• 2-Fluoro-6-trifluoromethylpyridine
IUPAC Name: 2-fluoro-6-(trifluoromethyl)pyridine | CAS Registry Number: 94239-04-0
Synonyms: TPC-PY087, ZINC02598026, 2-Fluoro-6-Trifluoromethylpyridine, 2-Fluoro-6-(trifluoromethyl)pyridine, CID2736501, TL8005954

Molecular Formula: C6H3F4NMolecular Weight: 165.088333 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: IZOIOCQPMHHDHN-UHFFFAOYSA-N

• 1-Aminocyclobutanecarboxylic acid
IUPAC Name: 1-aminocyclobutane-1-carboxylic acid | CAS Registry Number: 22264-50-2
Synonyms: Tocris-0258, 1y1z, SpecPlus_000653, Spectrum2_001476, Spectrum3_000743, Spectrum4_001046, Spectrum5_001835, Cyclobutanecarboxylic acid, 1-amino-, BSPBio_002326, KBioGR_001312, DivK1c_006749, SPBio_001431, 652369_ALDRICH, KBio1_001693, KBio3_001546, NSC 403363, ALBB-010153, CB 1700, BRN 2802253, 1-Amino-1-cyclobutanecarboxylic acid

Molecular Formula: C5H9NO2Molecular Weight: 115.130460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: FVTVMQPGKVHSEY-UHFFFAOYSA-N

• (S)-(-)-3-(Boc-amino)pyrrolidine
IUPAC Name: tert-butyl N-[(3S)-pyrrolidin-3-yl]carbamate | CAS Registry Number: 122536-76-9
Synonyms: (S)-3-(Boc-amino)pyrrolidine, (s)-3-n-boc-aminopyrrolidine, (3S)-(-)-3-(tert-Butoxycarbonylamino)pyrrolidine, s-3bocap, (S)-(+)-3-(Boc-amino)pyrrolidine, (s)-tert-butyl pyrrolidin-3-ylcarbamate, (s)-(-)-3-(boc-amino)pyrrolidine, (3S)-(-)-3-(Boc-amino)pyrrolidine, (s)-3-(tboc-amino)pyrrolidine, boc-(3s)-(-)-(3)apyrolidi, tert-butyl N-[(3S)-pyrrolidin-3-yl]carbamate, tert-Butyl (S)-3-pyrrolidinylcarbamate, tert-butyl (S)-pyrrolidin-3-ylcarbamate, (s)-3-aminopyrrolidine, 3-boc protected, ST50825255, (s)-pyrrolidin-3-yl-carbamic acid tert-butyl ester, tert-butyl (3S)-pyrrolidin-3-ylcarbamate, AC1LTTG9, AC1Q1MUO, SureCN133307

Molecular Formula: C9H18N2O2Molecular Weight: 186.251420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DQQJBEAXSOOCPG-ZETCQYMHSA-N

• (R)-(+)-3-(Boc-amino)pyrrolidine
IUPAC Name: tert-butyl N-[(3R)-pyrrolidin-3-yl]carbamate | CAS Registry Number: 122536-77-0
Synonyms: (R)-3-(Boc-amino)pyrrolidine, (r)-3-n-boc-aminopyrrolidine, (r)-tert-butyl pyrrolidin-3-ylcarbamate, (3R)-(+)-3-(tert-Butoxycarbonylamino)pyrrolidine, (R)-3-Boc-aminopyrrolidine, (3R)-(+)-3-(Boc-amino)pyrrolidine, tert-butyl N-[(3R)-pyrrolidin-3-yl]carbamate, (R)-3-(+)-(Boc-amino)pyrrolidine, AG-D-48923, (r)-pyrrolidin-3-yl-carbamic acid tert-butyl ester, tert-Butyl (R)-3-pyrrolidinylcarbamate, tert-butyl (3R)-pyrrolidin-3-ylcarbamate, r-3bocap, AC1LTTGB, PubChem11223, SureCN183834, AC1Q1MT8, (r)-3n-boc-aminopyrrolidine, KSC496Q5N, r-3-(boc-amino)-pyrrolidine

Molecular Formula: C9H18N2O2Molecular Weight: 186.251420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DQQJBEAXSOOCPG-SSDOTTSWSA-N


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