AG00372N

56026-36-9 | 3-Pyridinecarboxylicacid, 6-(hydroxymethyl)-, methyl ester

AG00372N

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CAS Number	56026-36-9
Catalog Number	AG00372N(AGN-PC-0OCAV3)
Chemical Name	3-Pyridinecarboxylicacid, 6-(hydroxymethyl)-, methyl ester
IUPAC Name	methyl 6-(hydroxymethyl)pyridine-3-carboxylate
InChI	InChI=1S/C8H9NO3/c1-12-8(11)6-2-3-7(5-10)9-4-6/h2-4,10H,5H2,1H3
InChI Key	QVLONHSXRWCCAE-UHFFFAOYSA-N
MDL Number	MFCD00643821
Molecular Formula	C8H9NO3
Molecular Weight	167.1620
SMILES	COC(=O)c1ccc(nc1)CO
Synonyms	methyl 6-(hydroxymethyl)nicotinate, 56026-36-9, 6-Hydroxymethyl-nicotinic acid methyl ester, methyl 6-(hydroxymethyl)pyridine-3-carboxylate, 6-Hydroxymethylnicotinic acid methyl ester, 6-Hydroxymethyl-nicotinicacidmethylester, methyl 6-hydroxymethylnicotinate, 3-Pyridinecarboxylicacid, 6-(hydroxymethyl)-, methyl ester, 3-Pyridinecarboxylic acid, 6-(hydroxymethyl)-, methyl ester, PubChem19720, AC1LG5VS, methylhydroxymethylnicotinate, AC1Q5ZC7, Oprea1_125747, Oprea1_479622, CBDivE_012360, KSC604K2T, SCHEMBL204895, AC1Q43P7, AC1Q43P8, AMPD00245, CTK5A4529, methyl 6-hydroxymethyl-nicotinate, methyl6-(hydroxymethyl)nicotinate, DTXSID00355022, QVLONHSXRWCCAE-UHFFFAOYSA-N, HMS1683H02, ZINC289111, ACT04524, BCP26466, EBD50844, ANW-50675, CL0242, CM-753, MFCD00643821, SBB053825, AKOS000512710, AB06608, CS-W002650, MCULE-2389795719, QC-8369, RP10388, VP15217, AC-23249, AJ-18914, AK-23866, AN-40261, BAS 00269748, BR-23866, CJ-02679, SC-14829, SY007641, ZB010200, AB0003789, DB-013385, ST2413463, TR-019720, 4CH-006381, 6-(Hydroxymethyl)nicotinic Acid Methyl Ester, AM20070104, C2844, FT-0648897, M2750, ST50220565, W6988, EN300-89661, KS-00000813, MFCD00643821 (97%), A-6527, methyl 2-(hydroxymethyl)pyridine-5-carboxylate, AB00076052-01, 026H369, 5W-0644, I02-0490, J-522516, 6-(Hydroxymethyl)pyridine-3-carboxylate Methyl Ester, 6-(Hydroxymethyl)pyridine-3-carboxylic acid methyl ester, 6-Hydroxymethyl-nicotinic acid methyl ester, AldrichCPR, Z1139751257, METHYL6- NICOTINATE, C8H9NO3, AR-1J5599, CID789414, 564-96-5,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.058g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	167.164g/mol
Monoisotopic Mass	167.058g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number