AG003S1D

93-60-7 | 3-​Pyridinecarboxylic acid, methyl ester

AG003S1D

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CAS Number	93-60-7
Catalog Number	AG003S1D(AGN-PC-006I4G)
Chemical Name	3-​Pyridinecarboxylic acid, methyl ester
EC Number	202-261-8
FEMA Number	3709
IUPAC Name	methyl pyridine-3-carboxylate
InChI	InChI=1S/C7H7NO2/c1-10-7(9)6-3-2-4-8-5-6/h2-5H,1H3
InChI Key	YNBADRVTZLEFNH-UHFFFAOYSA-N
MDL Number	MFCD00006388
Molecular Formula	C7H7NO2
Molecular Weight	137.1360
SMILES	C(=O)(OC)c1cccnc1
UNII	7B1AVU9DJN
Synonyms	methyl nicotinate, methylnicotinate, METHYL NICOTINATE, 93-60-7, methyl pyridine-3-carboxylate, Nikomet, Methylnicotinate, Nicotinic acid methyl ester, Nicometh, Methyl 3-pyridinecarboxylate, Methyl-nicotinate, 3-Pyridinecarboxylic acid, methyl ester, Nicotinic acid, methyl ester, 3-(Carbomethoxy)pyridine, m-(Methoxycarbonyl)pyridine, 3-(Methoxycarbonyl)pyridine, Heat spray, 3-Picolinic acid methyl ester, UNII-7B1AVU9DJN, NSC 13126, 3PyrCOOMe, Heat spray (TN), FEMA No. 3709, 3-Carbomethoxypyridine, Methyl nicotinate, 99%, EINECS 202-261-8, MFCD00006388, 7B1AVU9DJN, Methyl nicotinate (USAN), Methyl nicotinate [USAN], 3-Pyridinecarboxylic acid methyl ester, BRN 0113951, AI3-19241, YNBADRVTZLEFNH-UHFFFAOYSA-N, NCGC00159479-02, Methyl ester of pyridine-3-carboxylic acid, WLN: T6NJ CVO1, DSSTox_CID_24471, DSSTox_RID_80253, DSSTox_GSID_44471, CAS-93-60-7, methyl nicotinoate, Nicotinic acid methyl, ACMC-20aioj, PubChem11724, AC1Q5ZBZ, AC1L1O4J, methylpyridine-3-carboxylate, SCHEMBL24566, 5-22-02-00059 (Beilstein Handbook Reference), KSC274Q6R, CHEMBL379845, ZINC1706, 3-Picolinic acid methyl ester, DTXSID7044471, FEMA 3709, KS-00000BEF, CHEBI:134761, Methyl nicotinate, >=99%, FG, HMS1775A18, CS-D1355, NSC13126, Tox21_111702, Tox21_302038, ANW-75137, BBL012574, FC1289, NSC-13126, NSC403799, SBB040924, STK803258, Methyl nicotinate, analytical standard, AKOS000119439, Tox21_111702_1, CM10959, DB13882, GS-3032, LS20584, MCULE-2161067131, NSC-403799, NCGC00159479-03, NCGC00159479-05, NCGC00255708-01, AC-22482, AJ-08072, AK-47410, AN-24267, BR-47410, LS-96585, SC-18077, AB0007776, AB1000383, DB-031973, ST2413502, TL8005930, TR-032937, AM20061626, FT-0645164, N0086, ST45174806, Methyl nicotinate, puriss., >=99.0% (GC), 3-Picolinic acid methyl ester;Methyl nicotinate, D04991, M-5948, AC-907/25014170, SR-01000944497, Q-201381, SR-01000944497-1, F0001-2240, Methyl nicotinate, European Pharmacopoeia (EP) Reference Standard, InChI=1/C7H7NO2/c1-10-7(9)6-3-2-4-8-5-6/h2-5H,1H, Methyl Nicotinate, Pharmaceutical Secondary Standard; Certified Reference Material, methylnicotinat-, 2,4-Dimethoxypyrimidine, C7H7NO2, CID7151, C7-H7-N-O2, AR-1K7336, ACN-050022, Methyl nicotinate, 99% - 100G 100g, C008473, 3551-55-1, 5455-14-1,

Complexity	125
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	137.048g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	137.138g/mol
Monoisotopic Mass	137.048g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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