AG007SFV

18617-50-0 | 6-Hydroxynicotinic acid ethyl ester

AG007SFV

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CAS Number	18617-50-0
Catalog Number	AG007SFV(AGN-PC-0JPEVK)
Chemical Name	6-Hydroxynicotinic acid ethyl ester
IUPAC Name	ethyl 6-oxo-1H-pyridine-3-carboxylate
InChI	InChI=1S/C8H9NO3/c1-2-12-8(11)6-3-4-7(10)9-5-6/h3-5H,2H2,1H3,(H,9,10)
InChI Key	YYNSXKLGLKOLQZ-UHFFFAOYSA-N
MDL Number	MFCD08460993
Molecular Formula	C8H9NO3
Molecular Weight	167.1620
NSC Number	165477
SMILES	C(OC(=O)C1=CNC(=O)C=C1)C
Synonyms	Ethyl 6-hydroxynicotinate, 18617-50-0, 6-HYDROXYNICOTINIC ACID ETHYL ESTER, ethyl 6-oxo-1,6-dihydropyridine-3-carboxylate, ethyl 6-hydroxypyridine-3-carboxylate, YYNSXKLGLKOLQZ-UHFFFAOYSA-N, 6-hydroxy-nicotinic acid ethyl ester, ethyl 6-oxo-1,6-dihydro-3-pyridinecarboxylate, 6-oxo-1,6-dihydropyridine-3-carboxylic acid ethyl ester, 3-Pyridinecarboxylic acid, 1,6-dihydro-6-oxo-, ethyl ester, 6-Hydroxy-nicotinicacidethylester, PubChem23611, AC1L6P3A, Ethyl 6-hydroxynicotinate #, KSC493A5P, SCHEMBL152572, 6-Hydroxynicotinicacidethylester, CTK3J3057, CTK6F6167, DTXSID90304342, ACN-P000932, 6-Hydroxynicotinic acid, ethyl ester, ANW-50673, CE-251, MFCD08460993, NSC165477, SBB088065, ZINC12958611, AKOS009115027, AKOS015838701, ethyl 6-oxohydropyridine-3-carboxylate, AS-8016, ethyl 6-oxo-1H-pyridine-3-carboxylate, GS-6500, HP12045, NSC 165497, NSC-165477, QC-8991, RD-0198, RTR-008592, VZ36065, 5-carboethoxy-2-oxo-1,2-dihydropyridine, AC-26692, AJ-63321, AK-25535, BC228001, BR-25535, CJ-14296, U990, AB0019594, AB0093366, ST2413059, TL8001504, TR-008592, 4CH-001467, CS-0029520, FT-0084367, FT-0649187, 6-Hydroxy-3-pyridinecarboxylic acid ethyl ester, S-2984, 6-hydroxy-pyridine-3-carboxylic acid ethyl ester, 617O500, AP-402/41884914, I02-2083, J-521197, 6-Oxo-1,6-dihydro-pyridine-3-carboxylic acid ethyl ester, Ethyl6-hydroxynicotinate, C8H9NO3, CID295861, ACN-000932, A4119,

Complexity	266
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	3
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	55.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number