AG002I7B

189281-66-1 | 3-Pyridinecarboxylic acid, 2,6-dichloro-5-fluoro-, methyl ester

AG002I7B

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CAS Number	189281-66-1
Catalog Number	AG002I7B(AGN-PC-0KKWSW)
Chemical Name	3-Pyridinecarboxylic acid, 2,6-dichloro-5-fluoro-, methyl ester
IUPAC Name	methyl 2,6-dichloro-5-fluoropyridine-3-carboxylate
InChI	InChI=1S/C7H4Cl2FNO2/c1-13-7(12)3-2-4(10)6(9)11-5(3)8/h2H,1H3
InChI Key	WADLLLSMEPLCNO-UHFFFAOYSA-N
MDL Number	MFCD02180634
Molecular Formula	C7H4Cl2FNO2
Molecular Weight	224.0166
SMILES	COC(=O)c1cc(F)c(nc1Cl)Cl
Synonyms	METHYL 2,6-DICHLORO-5-FLUORONICOTINATE, 189281-66-1, methyl 2,6-dichloro-5-fluoropyridine-3-carboxylate, 3-Pyridinecarboxylic acid, 2,6-dichloro-5-fluoro-, methyl ester, 3-Pyridinecarboxylicacid, 2,6-dichloro-5-fluoro-, methyl ester, AC1MCQ66, SCHEMBL113592, AC1Q430S, CTK4E0089, DTXSID50379536, WADLLLSMEPLCNO-UHFFFAOYSA-N, ZINC163631, KS-00000J1J, MFCD02180634, SBB053867, AKOS025116799, AB11445, AK327351, DS-11956, ZB008016, DB-065683, RT-013738, CS-0081045, FT-0628418, V4025, K-5671, 2,6-dichloro-5-fluoro-nicotinic acid methyl ester, A813312, 2,6-Dichloro-3-fluoro-5-(methoxycarbonyl)pyridine, methyl 2,6-dichloro-5-fluoro-3-pyridinecarboxylate, I14-55771, 2,6-dichloro-5-fluoro-3-pyridinecarboxylic acid methyl ester, methyl 2,6-bis(chloranyl)-5-fluoranyl-pyridine-3-carboxylate, C7H4Cl2FNO2, ZINC00163631, CID2775354,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.96g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	224.012g/mol
Monoisotopic Mass	222.96g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

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

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