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RR Labs Inc.

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Profile: RR Labs Inc. is a manufacturer of custom chemicals. Our list of products includes pyridine, isothiazoles, oxyindoles, boronic acids and chromones.

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• Benzoic acid, 2-(bromomethyl)-3-nitro-, methyl ester
IUPAC Name: methyl 2-(bromomethyl)-3-nitrobenzoate | CAS Registry Number: 98475-07-1
Synonyms: Methyl 2-(bromomethyl)-3-nitrobenzoate, Methyl 2-bromomethyl-3-nitrobenzoate, 2-BROMOMETHYL-3-NITROBENZOIC ACID METHYL ESTER, Methyl2-bromomethyl-3-nitrobenzoate, SBB064270, AG-H-99647, 2-Bromomethyl-3-nitrobenzoicacid methyl ester, BENZOIC ACID, 2-(BROMOMETHYL)-3-NITRO-, METHYL ESTER, 2-Bromomethyl-3-nitro benzoic acid methyl ester, ZINC01402301, zlchem 474, AC1LSGVO, PubChem19169, SureCN332011, KSC496G1P, CTK3J6317, ZLC0339, MolPort-002-344-323, ACT00740, ANW-47137

Molecular Formula: C9H8BrNO4Molecular Weight: 274.068120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: FCGIVHSBEKGQMZ-UHFFFAOYSA-N

• Boc-Phe(3-Br)-OH
IUPAC Name: (2S)-3-(3-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid | CAS Registry Number: 82278-73-7
Synonyms: Boc-L-3-Bromophenylalanine, (S)-N-Boc-3-Bromophenylalanine, FS011383, TL8006699

Molecular Formula: C14H18BrNO4Molecular Weight: 344.201020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FBUDYESOPLBQIR-NSHDSACASA-N

• Cis-2-Penten-1-Ol
IUPAC Name: (Z)-pent-2-en-1-ol | CAS Registry Number: 1576-95-0
Synonyms: cis-2-Penten-1-ol, 2-Penten-1-ol, (Z)-, cis-Pent-2-ene-1-ol, (Z)-2-Penten-1-ol, (Z)-Pent-2-en-1-ol, 2-Penten-1-ol, (2Z)-, 304182_ALDRICH, ZINC05224689, EINECS 216-415-7, LMFA05000110, CID5364919, FS000334

Molecular Formula: C5H10OMolecular Weight: 86.132300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BTSIZIIPFNVMHF-ARJAWSKDSA-N

• Cyclobutyl-Pyridin-3-Ylmethyl-Amine
IUPAC Name: N-(pyridin-3-ylmethyl)cyclobutanamine | CAS Registry Number: 185509-76-6
Synonyms: MolPort-000-150-009, Cyclobutyl-pyridin-3-ylmethyl-amine, FS005043

Molecular Formula: C10H14N2Molecular Weight: 162.231560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UFFMGQWREGJEFM-UHFFFAOYSA-N

• Cyclopropanamine, 1-(4-fluorophenyl)-
IUPAC Name: 1-(4-fluorophenyl)cyclopropan-1-amine | CAS Registry Number: 474709-83-6
Synonyms: 1-(4-Fluorophenyl)cyclopropanamine, 1-(4-fluorophenyl)cyclopropan-1-amine, 1-(4-FLUORO-PHENYL)-CYCLOPROPYLAMINE, 1-(4-Fluorophenyl)cyclopropylamine, CYCLOPROPANAMINE, 1-(4-FLUOROPHENYL)-, SureCN56590, ACMC-1AM6H, AC1Q50FT, AGN-PC-00KBW3, CTK1D5598, MolPort-002-683-055, 1-(4-Fluorophenyl)cyclopropylamine,, ANW-30527, WTI-10422, AKOS000773666, 1-(4-fluorophenyl)-1-cyclopropanamine, AB39550, AG-C-28531, MCULE-8230566779, AK-90842

Molecular Formula: C9H10FNMolecular Weight: 151.180803 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JZDJCPUJSHPOJP-UHFFFAOYSA-N

• Dimethyl 4-Aminothiophene-2,3-Dicarboxylate
IUPAC Name: dimethyl 4-aminothiophene-2,3-dicarboxylate | CAS Registry Number: 62947-31-3
Synonyms: Dimethyl 4-aminothiophene-2,3-dicarboxylate, 4-Amino-thiophene-2,3-dicarboxylic acid dimethyl ester, ZINC00082653, AC1MCRUX, Maybridge1_003840, AC1Q41VY, SureCN2182359, CTK6I8662, HMS552G12, MolPort-000-881-469, ACT03678, ANW-45794, SBB095107, AKOS000277483, AC-5188, AG-A-71838, MCULE-2234132477, OR24367, AK-87926, FS000914

Molecular Formula: C8H9NO4SMolecular Weight: 215.226360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: XQPDCUCAKYNVAO-UHFFFAOYSA-N

• Eflornithine Hydrochloride
IUPAC Name: 2,5-diamino-2-(difluoromethyl)pentanoic acid hydrochloride | CAS Registry Number: 68278-23-9
Synonyms: DFMO HCl, EFLORNITHINE, .alpha.-DFMO HCl, DFMO hydrochloride hydrate, EFLORNITHINE HYDROCHLORIDE, CCRIS 5805, D193_SIGMA, MLS000069341, MLS001332583, EINECS 269-532-0, Eflornithine hydrochloride [USAN], Eflornithine hydrochloride monohydrate, MDL 71,782 A, NSC270295, NCGC00093850-01, 2-(Difluoromethyl)-DL-ornithine hydrochloride, LS-98405, SMR000058442, D,L-alpha-Difluoromethylornithine hydrochloride, DL-Ornithine, 2-(difluoromethyl)-, monohydrochloride

Molecular Formula: C6H13ClF2N2O2Molecular Weight: 218.629426 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: VKDGNNYJFSHYKD-UHFFFAOYSA-N

• Ethyl 2-[(5-Bromo-3-Nitropyridin-2-Yl)oxy]acetate
IUPAC Name: ethyl 2-(5-bromo-3-nitropyridin-2-yl)oxyacetate | CAS Registry Number: 105544-30-7
Synonyms: Ethyl 2-((5-bromo-3-nitropyridin-2-yl)oxy)acetate, ST51008737, ETHYL 2-(5-BROMO-3-NITROPYRIDIN-2-YLOXY)ACETATE, 105612-78-0, AC1NESWH, SureCN751950, CTK8C2150, MolPort-004-968-723, ANW-67894, ZINC05585673, AKOS015891742, AK-82012, KB-50780, FT-0689867, ethyl 2-(5-bromo-3-nitro-2-pyridyloxy)acetate, A801277, ethyl 2-(5-bromo-3-nitropyridin-2-yl)oxyacetate, I02-1625, ethyl 2-(5-bromanyl-3-nitro-pyridin-2-yl)oxyethanoate, 2-[(5-bromo-3-nitro-2-pyridinyl)oxy]acetic acid ethyl ester

Molecular Formula: C9H9BrN2O5Molecular Weight: 305.082160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: UHIILDDDMFTHKM-UHFFFAOYSA-N

• Ethyl 5-Amino-3-Methylisothiazole-4-Carboxylate
IUPAC Name: ethyl 5-amino-3-methyl-1,2-thiazole-4-carboxylate | CAS Registry Number: 34859-65-9
Synonyms: Maybridge1_004847, Oprea1_213349, Oprea1_727648, CHEBI:570075, ZINC00126361, ALBB-002111, STK434279, CID2820511, KM04205, ethyl 5-amino-3-methylisothiazole-4-carboxylate, ethyl 5-amino-3-methyl-1,2-thiazole-4-carboxylate, SR-01000631359-1

Molecular Formula: C7H10N2O2SMolecular Weight: 186.231500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZDGBWOZFPKNORL-UHFFFAOYSA-N

• Homomorpholine hydrochloride
IUPAC Name: 1,4-oxazepane;hydrochloride | CAS Registry Number: 178312-62-4
Synonyms: homomorpholine hydrochloride, 1,4-oxazepane hydrochloride, HOMOMORPHOLINE HCL, SureCN58640, CTK8B4985, MolPort-003-987-552, HT472, ANW-46957, HT1123, WTI-11869, hexahydro-1,4-Oxazepine hydrochloride, AKOS015848578, RP08335, 1,4-Oxazepine, hexahydro-, hydrochloride, AK-81388, KB-52404, TL8006240, WT-130159, AM20090058, FT-0084799

Molecular Formula: C5H12ClNOMolecular Weight: 137.607880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LJRCWNIWOVZLKS-UHFFFAOYSA-N

• Imidazoles
IUPAC Name: (3aR)-1,3,3a,4,5,6,7,7a-octahydrobenzimidazole-2-thione | CAS Registry Number: 139237-77-7
Synonyms: (R,R)-Octahydro-benzoimidazole-2-thione

Molecular Formula: C7H12N2SMolecular Weight: 156.248580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: INYFNNKRGLROQV-LWOQYNTDSA-N

• Methyl 3-Oxocyclobutanecarboxylate
IUPAC Name: methyl 3-oxocyclobutane-1-carboxylate | CAS Registry Number: 695-95-4
Synonyms: METHYL 3-OXOCYCLOBUTANECARBOXYLATE, methyl 3-oxocyclobutane-1-carboxylate, AG-G-71099, CYCLOBUTANECARBOXYLIC ACID, 3-OXO-, METHYL ESTER, SureCN872959, KSC630K4P, AGN-PC-0001YP, Methyl3-oxocyclobutanecarboxylate, CTK5D0547, MolPort-015-163-768, HT483, Methyl 3-oxo-cyclobutanecarboxylate, 3-METHOXYCARBONYLCYCLOBUTANONE, ANW-49081, ZINC34203349, AKOS006228714, PB32215, RP08831, AK-77056, BR-77056

Molecular Formula: C6H8O3Molecular Weight: 128.125920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: IHLHSAIBOSSHQV-UHFFFAOYSA-N

• Methyl 5-bromo-2-thiophenecarboxylate
IUPAC Name: methyl 5-bromothiophene-2-carboxylate | CAS Registry Number: 62224-19-5
Synonyms: methyl 5-bromothiophene-2-carboxylate, 5-Bromo-thiophene-2-carboxylic acid methyl ester, 5-Bromo-thiophene-2-carboxylic acid methylester, AG-G-28281, ST50829770, 5-bromo-2-thiophenecarboxylic acid methyl ester, AC1LCS1H, SureCN70702, CTK5B4790, MolPort-001-554-635, ANW-50092, RW2802, STK429655, ZINC02801132, AKOS003300574, MCULE-1637297856, PB24794, QC-1872, methyl 5-bromanylthiophene-2-carboxylate, AK-40321

Molecular Formula: C6H5BrO2SMolecular Weight: 221.071700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QLWUHAQCKDHUNL-UHFFFAOYSA-N

• Methyl sulfonoyl methyl amine
IUPAC Name: N-methylmethanesulfonamide | CAS Registry Number: 1184-85-6
Synonyms: N-Methylmethanesulfonamide, Methanesulfonamide, N-methyl-, Methanesulfonic acid methylamide, Methansulfonic acid-n-methylamide, NSC 137909, BRN 1633748, Methansulfonsaure-N-methylamid [German], NSC137909, BBV-030293, LS-90147, 4-04-00-00268 (Beilstein Handbook Reference)

Molecular Formula: C2H7NO2SMolecular Weight: 109.147480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UHNHTTIUNATJKL-UHFFFAOYSA-N

• N-(6-Bromo-Pyridin-3-Yl)-2,2-Difluoro-Acetamide
IUPAC Name: N-(6-bromopyridin-3-yl)-2,2-difluoroacetamide | CAS Registry Number: 850349-86-9
Synonyms: MolPort-000-150-251, ZINC15042811, FS011480, N-(6-Bromopyridin-3-yl)-2,2-difluoroacetamide

Molecular Formula: C7H5BrF2N2OMolecular Weight: 251.028206 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: TZFDXFUDTXKVSQ-UHFFFAOYSA-N

• N-(tert-Butyl)decahydroisoquinoline-3-carboxamide
IUPAC Name: (3S)-N-tert-butyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxamide | CAS Registry Number: 136465-81-1
Synonyms: FS000882, (S)-t-Butyl-decahydro-3-isoquinoline carboxamide

Molecular Formula: C14H26N2OMolecular Weight: 238.369040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UPZBXVBPICTBDP-MCIGGMRASA-N

• N-Boc-3-hydroxyazetidine
IUPAC Name: tert-butyl 3-hydroxyazetidine-1-carboxylate | CAS Registry Number: 141699-55-0
Synonyms: ZINC02527471, ALBB-009728, 1-BOC-3-(HYDROXY)AZETIDINE, CID2756801, FS011275, tert-butyl 3-hydroxyazetidine-1-carboxylate, TL8000922

Molecular Formula: C8H15NO3Molecular Weight: 173.209600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XRRXRQJQQKMFBC-UHFFFAOYSA-N

• N-Boc-Cis-4-Amino-L-Proline Methyl Ester / Hydrochloride Salt
IUPAC Name: 1-O-tert-butyl 2-O-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate;hydrochloride | CAS Registry Number: 171110-72-8
Synonyms: Methyl (2S,4S)-1-Boc-4-aminopyrrolidine-2-carboxylate hydrochloride, (2S,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate hydrochloride, 4-aminopyrrolidine-1,2-dicarboxylatehydrochloride, (S,S)-1-Boc-4-aminoproline methyl ester hydrochloride, SureCN1412084, CTK8C4938, MolPort-003-981-842, ANW-73561, AKOS015969096, AKOS016015694, PB23355, AK-47663, KB-144642, FT-0084091, FT-0659525, W3731, N-BOC-4-AMINO-L-PROLINE METHYL ESTER HYDROCHLORIDE, CIS-4-AMINO-N-BOC-L-PROLINE METHYL ESTER HYDROCHLORIDE, N-BOC-CIS-4-AMINO-L-PROLINE METHYL ESTER HYDROCHLORIDE, BOC-CIS-4-AMINO-L-PROLINE METHYL ESTER HYDROCHLORIDE SALT

Molecular Formula: C11H21ClN2O4Molecular Weight: 280.748440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: KFYCQKLSGMAVQH-WSZWBAFRSA-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-Methyl-1-naphthylmethylamine
IUPAC Name: N-methyl-1-naphthalen-1-ylmethanamine | CAS Registry Number: 14489-75-9
Synonyms: N-Methyl-1-naphthalenemethylamine, N-Methylnaphthalene-1-methylamine, 1-Methyl-1-naphthalenemethylamine, N-Methyl-1-Naphthalenemethyl amine, CID84474, NSC39782, 1-Naphthalenemethanamine, N-methyl-, EINECS 238-497-3, NSC129392, SBB005765, FS011322, TL8006167

Molecular Formula: C12H13NMolecular Weight: 171.238320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MQRIUFVBEVFILS-UHFFFAOYSA-N

• tert-Butyl 1,4-diazepane-1-carboxylate
IUPAC Name: tert-butyl 1,4-diazepane-1-carboxylate | CAS Registry Number: 112275-50-0
Synonyms: 1-Boc-homopiperazine, 1-Boc-1,4-diazepane, 511382_ALDRICH, 1-Boc-hexahydro-1,4-diazepine, ALBB-006930, N-(tert-Butoxycarbonyl)homopiperazine, tert-Butyl homopiperazine-1-carboxylate, tert-butyl 1,4-diazepane-1-carboxylate, AW 00210, FS000063, TL8000358

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WDPWEXWMQDRXAL-UHFFFAOYSA-N

• Tert-Butyl 3-Oxoazetidine-1-Carboxylate
IUPAC Name: tert-butyl 3-oxoazetidine-1-carboxylate | CAS Registry Number: 398489-26-4
Synonyms: 1-Boc-3-azetidinone, 1-Boc-azetidin-3-one, C-3186K, TL8002873

Molecular Formula: C8H13NO3Molecular Weight: 171.193720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VMKIXWAFFVLJCK-UHFFFAOYSA-N

• Tetrahydro-3-Thiophenamine 1,1-Dioxide Hydrochloride
IUPAC Name: 1,1-dioxothiolan-3-amine hydrochloride | CAS Registry Number: 51642-03-6
Synonyms: NSC119148, CID2795201, 1,1-dioxothiolan-3-amine Hydrochloride, EN300-08033

Molecular Formula: C4H10ClNO2SMolecular Weight: 171.645700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: MGZQMSFXPSKBDY-UHFFFAOYSA-N

• Urea, N-(2,2-Diethoxyethyl)-N'-2-Propen-1-Yl-
IUPAC Name: 1-(2,2-diethoxyethyl)-3-prop-2-enylurea | CAS Registry Number: 107979-42-0
Synonyms: 1-(2,2-DIETHOXYETHYL)-3-ALLYLUREA, 1-Allyl-3-(2,2-diethoxyethyl)urea, AG-D-24074, AGN-PC-001J3U, CTK4A5798, MolPort-004-968-992, ANW-62191, ZINC39326070, AKOS015900071, AK102366, KB-08080, FT-0689850, Urea, N-(2,2-diethoxyethyl)-N'-2-propenyl-, I14-10111

Molecular Formula: C10H20N2O3Molecular Weight: 216.277400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IGIVZSSFWNWHCU-UHFFFAOYSA-N

• Urea, N-(2,2-Diethoxyethyl)-N'-Methoxy-
IUPAC Name: 1-(2,2-diethoxyethyl)-3-methoxyurea | CAS Registry Number: 116451-49-1
Synonyms: 1-(2,2-Diethoxyethyl)-3-methoxyurea, AGN-PC-00OG4F, CTK8B9196, MolPort-004-969-009, ANW-62190, ZINC39326086, AKOS015900073, N-(2,2-diethoxyethyl)-N'-methoxy-Urea, AK102367, KB-62207, Urea, N-(2,2-diethoxyethyl)-N'-methoxy-, FT-0689849, I14-10114

Molecular Formula: C8H18N2O4Molecular Weight: 206.239520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BHXLZXJRTXHILL-UHFFFAOYSA-N

• Urea, N-(2,2-Diethoxyethyl)-N'-Methyl-
IUPAC Name: 1-(2,2-diethoxyethyl)-3-methylurea | CAS Registry Number: 61224-27-9
Synonyms: 1-(2,2-DIETHOXYETHYL)-3-METHYLUREA, AG-G-22863, CTK5B2888, MolPort-004-968-990, ANW-62159, ZINC13493659, AKOS006324939, 1-(2,2-Diethoxyethyl)-3-methyl urea, AK102405, KB-08082, N-(2,2-Diethoxyethyl)-N'-methyl-Urea;, Urea,N-(2,2-diethoxyethyl)-N'-methyl-, FT-0689847, I14-10568

Molecular Formula: C8H18N2O3Molecular Weight: 190.240120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: LYSNINURKGPALG-UHFFFAOYSA-N

• (+)-Ethyl (S)-2-Amino-4-Cyclohexylbutyrate Hydrochloride
IUPAC Name: ethyl (2S)-2-amino-4-cyclohexylbutanoate hydrochloride | CAS Registry Number: 402474-20-8
Synonyms: 70031_FLUKA, 78706_FLUKA, MolPort-000-150-461, FS003021, (S)-Ethyl 2-amino-4-cyclohexylbutyrate hydrochloride, (+)-Ethyl (S)-2-amino-4-cyclohexylbutyrate hydrochloride, (-)-Ethyl (R)-2-amino-4-cyclohexylbutyrate hydrochloride

Molecular Formula: C12H24ClNO2Molecular Weight: 249.777460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GPPVARHUGJVMMH-MERQFXBCSA-N

• (+/-)-3-Aminohomopiperidine
IUPAC Name: azepan-3-amine | CAS Registry Number: 69154-03-6
Synonyms: 3-Aminohomopiperidine, Azepan-3-amine, (+/-)-3-amino-homopiperidine, azepan-3-ylamine, Hexahydro-1H-azepin-3-amine, rac-azepan-3-amine, 3-amino-homopiperidine, AG-G-68841, (R)-3-AMINO-HEXAHYDRO-1H-AZEPIN, AC1MBTL8, SureCN913514, (+/-)-3-aminohomopiperidine, 1H-Azepin-3-amine,hexahydro-, CTK5C9157, MolPort-000-151-093, ACT01819, ANW-51510, SBB069776, AKOS011935651, AB11528

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

InChIKey: WJUBYASTGWKFHK-UHFFFAOYSA-N

• (1-Oxy-Pyridin-3-Yl)-Acetonitrile
IUPAC Name: 2-(1-oxidopyridin-1-ium-3-yl)acetonitrile | CAS Registry Number: 6635-88-7
Synonyms: NSC52455, MolPort-000-150-199, (1-Oxy-pyridin-3-yl)-acetonitrile, CID243167, ZINC01684043, 7P-396S, FS011416

Molecular Formula: C7H6N2OMolecular Weight: 134.135340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: OGPFILFOKYMAKO-UHFFFAOYSA-N

• (1-phenylcyclopropyl)methylamine
IUPAC Name: (1-phenylcyclopropyl)methanamine | CAS Registry Number: 935-42-2
Synonyms: 1-Phenylcyclopropanemethylamine, 1-(Phenylcyclopropyl)methylamine, EINECS 213-302-4, ST5437550

Molecular Formula: C10H13NMolecular Weight: 147.216920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: FUEMGCALFIHXAS-UHFFFAOYSA-N

• (1r, 2r, 5s, 7r)-2,8,8,Trimethyl-3-Azatricyclo[5.1.1.0(2,5)]Nonane-4-One
Synonyms: (1R,2R,5S,7R)-8,8-Dimethyl-3-azatricyclo[5.1.1.0^2,5]nonan-4-one

Molecular Formula: C10H15NOMolecular Weight: 165.232200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SFZASXHNQGKLND-UHFFFAOYSA-N

• (1s, 2s, 5r, 7s)-2,8,8,Trimethyl-3-Azatricyclo[5.1.1.0{2,5}]Nonane-4-One
Synonyms: SureCN3375445, ZINC15043163, (1S, 2S, 5R, 7S)-2,8,8,Trimethyl-3-azatricyclo[5.1.1.0{2,5}]nonane-4-one

Molecular Formula: C11H17NOMolecular Weight: 179.258780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KUAXJPRPFKYSME-OFHVYEONSA-N

• (2-[1,4]Diazepan-1-Yl-1-Methyl-2-Oxo-Ethyl)-Carbamic Acid Ter T-Butyl Ester
IUPAC Name: tert-butyl N-[1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]carbamate | CAS Registry Number: 864754-26-7
Synonyms: (2-[1,4]Diazepan-1-yl-1-methyl-2-oxo-ethyl)-carbamic acid tert-butyl ester, AGN-PC-01NP1M, CTK5F6795, AG-H-48819, KB-205749, tert-butyl N-[(2R)-1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]carbamate, Carbamic acid,[(1R)-2-(hexahydro-1H-1,4-diazepin-1-yl)-1-methyl-2-oxoethyl]-,1,1-dimethylethyl ester (9CI)

Molecular Formula: C13H25N3O3Molecular Weight: 271.355900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XGQKYXVXKHPGEW-UHFFFAOYSA-N

• (2e)-3-(5-Bromo(2-Thienyl))Prop-2-Enoic Acid
IUPAC Name: (E)-3-(5-bromothiophen-2-yl)prop-2-enoic acid | CAS Registry Number: 50868-68-3
Synonyms: MolPort-000-150-345, BBV-091135, CID2059999, FS001300, 3-(5-Bromo-2-thienyl)-2-propenoic acid, 3-(5-bromothiophen-2-yl)prop-2-enoic Acid, T5233958

Molecular Formula: C7H5BrO2SMolecular Weight: 233.082400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UNAWXLDSXIIUFC-DUXPYHPUSA-N

• (2S,4S)-4-Fluoro-1-tert-butoxycarbonyl-pyrrolidine-2-carboxylic acid
IUPAC Name: (2S,4S)-4-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid | CAS Registry Number: 203866-13-1
Synonyms: N-Boc-cis-4-fluoro-L-proline, (2S,4S)-1-(tert-Butoxycarbonyl)-4-fluoropyrrolidine-2-carboxylic acid, BOC-FLP-OH, N-tert-butoxycarbonyl-cis-4-fluoro-L-proline, (2S,4S)-1-(tert-Butoxycarbonyl)-4-fluoro-2-pyrrolidinecarboxylic Acid, BOC-CIS-PRO(4-F)-OH, BOC-CIS-4-FLUORO-PRO-OH, BOC-CIS-4-FLUORO-L-PROLINE, SBB065965, (2S,4S)-1-Boc-4-fluoro-2-pyrrolidinecarboxylic Acid, (2S,4S)-4-Fluoro-N-Boc-Pyrrolidine-2-carboxylic acid, N-T-BOC-CIS-4-FLUORO-L-PROLINE, (2S,4S)-4-FLUORO-1-TERT-BUTOXYCARBONYL-PYRROLIDINE-2-CARBOXYLIC ACID, CIS-4-FLUORO-L-PROLINE, N-BOC PROTECTED, N-(T-BUTOXYCARBONYL)-CIS-4-FLUORO-L-PROLINE, S,S-N-BOC-5-FLUOROPYRROLIDINE-2-CARBOXYLIC ACID, (2S,4S)-1-BOC-4-FLUOROPYRROLIDINE-2-CARBOXYLIC ACID, (2S,4S)-BOC-4-FLUORO-PYRROLIDINE-2-CARBOXYLIC ACID, BOC-(2S,4S)-4-FLUORO-PYRROLIDINE-2-CARBOXYLIC ACID, N-BOC-(4S,2S)-4-FLUORO-2-PYRROLIDINECARBOXYLIC ACID

Molecular Formula: C10H16FNO4Molecular Weight: 233.236743 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: YGWZXQOYEBWUTH-BQBZGAKWSA-N

• (3,4-Dimethoxy-Pyridin-2-Yl)-Acetonitrile
IUPAC Name: 2-(3,4-dimethoxypyridin-2-yl)acetonitrile | CAS Registry Number: 854278-84-5
Synonyms: MolPort-000-150-200, ZINC15042683, FS011417, (3,4-Dimethoxy-pyridin-2-yl)-acetonitrile

Molecular Formula: C9H10N2O2Molecular Weight: 178.187900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: NQARTKURTMEIBO-UHFFFAOYSA-N

• (3-Bromo-Phenoxy)-Difluoro-Acetic Acid Ethyl Ester
IUPAC Name: ethyl 2-(3-bromophenoxy)-2,2-difluoroacetate | CAS Registry Number: 850349-28-9
Synonyms: MolPort-000-150-020, ZINC15042244, FS010799, (3-Bromo-phenoxy)-difluoro-acetic acid ethyl ester

Molecular Formula: C10H9BrF2O3Molecular Weight: 295.077466 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: OYUUSOPGUZLOTL-UHFFFAOYSA-N

• (3-Methyl-Isothiazol-5-Yl)-Pyridin-2-Ylmethyl-Amine
IUPAC Name: 3-methyl-N-(pyridin-2-ylmethyl)-1,2-thiazol-5-amine | CAS Registry Number: 864684-73-1
Synonyms: (3-METHYL-ISOTHIAZOL-5-YL)-PYRIDIN-2-YLMETHYL-AMINE, AGN-PC-01NP29, CTK5F6688, AG-H-48695, KB-207444, 2-Pyridinemethanamine,N-(3-methyl-5-isothiazolyl)-, (3-methyl-isothiazol-5-yl)-(pyridin-2-yl)methyl-amine, 3-methyl-N-(pyridin-2-ylmethyl)-1,2-thiazol-5-amine

Molecular Formula: C10H11N3SMolecular Weight: 205.279440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RXUIEDCFXIRKSI-UHFFFAOYSA-N

• (4,4-Diethoxy-Butyl)-(4-Methyl-Pyridin-2-Yl)-Amine
IUPAC Name: N-(4,4-diethoxybutyl)-4-methylpyridin-2-amine | CAS Registry Number: 864685-05-2
Synonyms: AGN-PC-01NP2R, CTK5F6720, AG-H-48727, N-(4,4-diethoxybutyl)-4-methylpyridin-2-amine, (4,4-DIETHOXY-BUTYL)-(4-METHYL-PYRIDIN-2-YL)-AMINE, (4,4-DIETHOXY-BUTYL)-(4-METHYL-(PYRIDIN-2-YL))-AMINE

Molecular Formula: C14H24N2O2Molecular Weight: 252.352560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HJZCENMXWPBUBI-UHFFFAOYSA-N

• (4-Bromo-Naphth -1-Yl)methylamine Hydrochloride
IUPAC Name: (4-bromonaphthalen-1-yl)methanamine;hydrochloride | CAS Registry Number: 578029-09-1
Synonyms: 1-Aminomethyl-4-bromonaphthalene, HCl, (4-Bromonaphthalen-1-yl)methanamine hydrochloride, (4-BROMO-NAPHTH-1-YL)METHYLAMINE HYDROCHLORIDE, AGN-PC-01NOZE, SureCN1854457, CTK8B3763, MolPort-000-150-448, ANW-43129, AKOS015910105, AK-90757, KB-11150, 1-Aminomethyl-4-bromonaphthalene hydrochloride, I14-31086

Molecular Formula: C11H11BrClNMolecular Weight: 272.568740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: VMIHRIRAILUHFK-UHFFFAOYSA-N

• (5-Bromo-Pyridin-2-Yl)-(2,2-Dimethoxy-Ethyl)-Amine
IUPAC Name: 5-bromo-N-(2,2-dimethoxyethyl)pyridin-2-amine | CAS Registry Number: 474708-93-5
Synonyms: MolPort-000-141-292, OR8594, ZINC15041925, FS000789, (5-Bromo-pyridin-2-yl)-(2,2-dimethoxy-ethyl)-amine

Molecular Formula: C9H13BrN2O2Molecular Weight: 261.115720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: BKWCRQLPLJHUSY-UHFFFAOYSA-N

• (5-Nitro-2-furyl)methyl aminomethanimidothioate hydrobromide
IUPAC Name: (5-nitrofuran-2-yl)methyl carbamimidothioate hydrobromide | CAS Registry Number: 82118-18-1
Synonyms: XBX 00327, FS000337, SR-01000641017-1, (5-Nitrofuran-2-yl)methyl carbamimidothioate hydrobromide

Molecular Formula: C6H8BrN3O3SMolecular Weight: 282.115020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: NTIKNUAJKOAYOO-UHFFFAOYSA-N

• (6,7-Dihydro-4H-Pyrano[4,3-D]thiazol-2-Yl)-Acetonitrile
IUPAC Name: 2-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)acetonitrile | CAS Registry Number: 850349-44-9
Synonyms: MolPort-000-150-121, ZINC15042489, BBV-27035286, FS011331, 2-(6,7-Dihydro-4H-pyrano[4,3-d]thiazol-2-yl)acetonitrile

Molecular Formula: C8H8N2OSMolecular Weight: 180.226920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VAJLRWYUKKSNHZ-UHFFFAOYSA-N

• (6-Bromo-Pyridin-2-Yl)-Acetonitrile
IUPAC Name: 2-(6-bromopyridin-2-yl)acetonitrile | CAS Registry Number: 112575-11-8
Synonyms: 2-pyridineacetonitrile, 6-bromo-, MolPort-000-150-202, (6-bromopyridin-2-yl)acetonitrile, CID642864, ZINC15042691, (6-Bromo-pyridin-2-yl)-acetonitrile, FS011421, InChI=1/C7H5BrN2/c8-7-3-1-2-6(10-7)4-5-9/h1-3H,4H

Molecular Formula: C7H5BrN2Molecular Weight: 197.032000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WUYNZPVTHRDYDT-UHFFFAOYSA-N

• (8aS)-Octahydro-Pyrrolo[1,2-A]pyrazine
IUPAC Name: (8aR)-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine | CAS Registry Number: 93643-24-4
Synonyms: Octahydropyrrolo[1,2-a]pyrazine, (S)-Octahydro-pyrrolo[1,2-a]pyrazine, CID7004239, OR15657, FS011287

Molecular Formula: C7H14N2Molecular Weight: 126.199460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FTTATHOUSOIFOQ-SSDOTTSWSA-N

• (E)-Ethyl 3-(2-Bromo-4-(bromomethyl)phenyl)acrylate
IUPAC Name: ethyl 3-[2-bromo-4-(bromomethyl)phenyl]prop-2-enoate | CAS Registry Number: 864759-54-6
Synonyms: AGN-PC-01NOZ6, (E)-ETHYL 3-(2-BROMO-4-(BROMOMETHYL)PHENYL)ACRYLATE, CTK5F6825, AG-H-48861, ethyl (E)-3-[2-bromo-4-(bromomethyl)phenyl]prop-2-enoate, 2-Propenoic acid,3-[2-bromo-4-(bromomethyl)phenyl]-, ethyl ester, (E)-ETHYL 3-(2-BROMO-4-(BROMOMETHYL)PHENYL)ACRYLATE;(E)-Ethyl 3-(2-bromo-4-(bromomethyl)phenyl)acrylate >97%

Molecular Formula: C12H12Br2O2Molecular Weight: 348.030480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: OKSNICQPTJNJIV-UHFFFAOYSA-N

• (Furan-2-Ylmethanesulfinyl)-Acetic Acid Methyl Ester
IUPAC Name: methyl 2-(furan-2-ylmethylsulfinyl)acetate | CAS Registry Number: 864759-49-9
Synonyms: MolPort-000-150-184, FS011401, (Furan-2-ylmethanesulfinyl)-acetic acid methyl ester

Molecular Formula: C8H10O4SMolecular Weight: 202.227600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: PCHRYDWVGYYWOL-UHFFFAOYSA-N

• (r )-2-aminomethyl-pyrrolidine-1-carboxylic Acid Tert-butyl Ester
IUPAC Name: tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate | CAS Registry Number: 259537-92-3
Synonyms: (R)-1-Boc-2-(aminomethyl)pyrrolidine, FS011276

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SOGXYCNKQQJEED-UHFFFAOYSA-N

• (R)-(+)-1-(4-Bromophenyl)ethylamine
IUPAC Name: 1-(4-bromophenyl)ethanamine | CAS Registry Number: 45791-36-4
Synonyms: p-Bromo-alpha-methylbenzylamine, 154067_ALDRICH, 4-Bromo-alpha-methylbenzylamine, (+)-p-Bromo-.alpha.-phenethylamine, (-)-1-(4-Bromophenyl)ethylamine, EINECS 246-200-3, EINECS 256-245-0, (R)-4-Bromo-alpha-methylbenzylamine, SBB006746, Benzenemethanamine, 4-bromo-.alpha.-methyl-, (R)-, InChI=1/C8H10BrN/c1-6(10)7-2-4-8(9)5-3-7/h2-6H,10H2,1H, 24358-62-1, 27298-97-1

Molecular Formula: C8H10BrNMolecular Weight: 200.075700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SOZMSEPDYJGBEK-UHFFFAOYSA-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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