AG003Q87

58997-10-7 | Ethyl 3-methylpicolinate

AG003Q87

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CAS Number	58997-10-7
Catalog Number	AG003Q87(AGN-PC-0NI7OU)
Chemical Name	Ethyl 3-methylpicolinate
IUPAC Name	ethyl 3-methylpyridine-2-carboxylate
InChI	InChI=1S/C9H11NO2/c1-3-12-9(11)8-7(2)5-4-6-10-8/h4-6H,3H2,1-2H3
InChI Key	VKKVFRWNHZHHQU-UHFFFAOYSA-N
MDL Number	MFCD11616893
Molecular Formula	C9H11NO2
Molecular Weight	165.1891
SMILES	CCOC(=O)C1=NC=CC=C1C
Synonyms	ethyl 3-methylpicolinate, 58997-10-7, ETHYL 3-METHYLPYRIDINE-2-CARBOXYLATE, ETHYL 3-METHYL-2-PYRIDINECARBOXYLATE, Ethyl3-Methylpyridine-2-Carboxylate, 2-Pyridinecarboxylic acid, 3-methyl-, ethyl ester, SCHEMBL108857, KS-00000BJY, DTXSID70482096, VKKVFRWNHZHHQU-UHFFFAOYSA-N, MFCD11616893, ZINC39189706, AKOS011625752, AB64448, RL04223, TRA0080560, WT82054, AC-23519, AJ-98913, AK-83232, CJ-19823, CS-11273, SC-45716, SY013318, AB0036262, DB-072550, TC-308250, 4CH-001627, CS-0061547, FT-0698648, ST24046967, Y3303, Z-4217, 3-methyl-2-Pyridine carboxylic acid Ethyl ester, MFCD11616893 (97+%), I02-2800, J-520891, 3-METHYL-2-PYRIDINECARBOXYLIC ACID ETHYL ESTER, 3-METHYL-PYRIDINE-2-CARBOXYLIC ACID ETHYL ESTER, C9H11NO2, ACN-040422, A8314, 351210-06-5, 6485-79-6,

Complexity	159
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.079g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	165.192g/mol
Monoisotopic Mass	165.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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