AG00D8YA

53277-47-7 | 3-Pyridinecarboxylic acid, 2-chloro-6-methyl-, methyl ester

AG00D8YA

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CAS Number	53277-47-7
Catalog Number	AG00D8YA(AGN-PC-00KNX1)
Chemical Name	3-Pyridinecarboxylic acid, 2-chloro-6-methyl-, methyl ester
IUPAC Name	methyl 2-chloro-6-methylpyridine-3-carboxylate
InChI	InChI=1S/C8H8ClNO2/c1-5-3-4-6(7(9)10-5)8(11)12-2/h3-4H,1-2H3
InChI Key	SHKDOGHJQHIIRD-UHFFFAOYSA-N
MDL Number	MFCD11845763
Molecular Formula	C8H8ClNO2
Molecular Weight	185.6076
SMILES	O=C(OC)C1=C(Cl)N=C(C)C=C1
Synonyms	Methyl 2-chloro-6-methylnicotinate, 53277-47-7, 2-Chloro-6-methyl-nicotinic acid methyl ester, methyl 2-chloro-6-methylpyridine-3-carboxylate, 3-Pyridinecarboxylic acid, 2-chloro-6-methyl-, methyl ester, MFCD11845763, SCHEMBL334079, CTK6J0199, DTXSID80516619, SHKDOGHJQHIIRD-UHFFFAOYSA-N, methyl-2-chloro-6-methylnicotinate, KS-00000HF5, methyl 2-chloro-6-methyl-nicotinate, 7556AB, CL0086, SBB090333, ZINC39383166, AKOS015851497, AS-5555, CS-W022805, RP24574, SB12719, AC-23242, AK-28460, AB0002376, AJ-100094, DB-071654, TR-071936, 2-Chloro-6-methylnicotinic acid methyl ester, FT-0646292, 2-Chloro-3-(methoxycarbonyl)-6-methylpyridine, methyl 2-chloro-6-methyl-3-pyridinecarboxylate, J-521994, METHYL6-METHYL-2-CHLOROPYRIDINE-3-CARBOXYLATE, 2-chloro-6-methyl-3-pyridinecarboxylic acid methyl ester, 6-Methyl-2-chloropyridine-3-carboxylic acid methyl ester, 2-Chloro-6-methyl-3-pyridinecarboxylic acid, methyl ester, 3-Pyridinecarboxylicacid, 2-chloro-6-methyl-, methyl ester, C8H8ClNO2, Methyl2-chloro-6-methylnicotinate, METHYL 4-CHLORO-6-METHYLNICOTINATE, methyl 2-chloro-6-methylpyridine-3-carboxylate, 95% - 1G 1g,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.024g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	185.607g/mol
Monoisotopic Mass	185.024g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H319
Packing Group
Precautionary statements	P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

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