AG005AE6

74650-71-8 | 2-CHLORO-5-METHOXYNICOTINIC ACID

AG005AE6

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CAS Number	74650-71-8
Catalog Number	AG005AE6(AGN-PC-00JS28)
Chemical Name	2-CHLORO-5-METHOXYNICOTINIC ACID
IUPAC Name	2-chloro-5-methoxypyridine-3-carboxylic acid
InChI	InChI=1S/C7H6ClNO3/c1-12-4-2-5(7(10)11)6(8)9-3-4/h2-3H,1H3,(H,10,11)
InChI Key	AJKXOHPNDQHYDM-UHFFFAOYSA-N
MDL Number	MFCD16610607
Molecular Formula	C7H6ClNO3
Molecular Weight	187.5804
SMILES	COC1=CN=C(Cl)C(=C1)C(O)=O
Synonyms	2-Chloro-5-methoxynicotinic acid, 74650-71-8, 2-CHLORO-5-METHOXYPYRIDINE-3-CARBOXYLIC ACID, 2-CHLORO-5-METHOXY-3-PYRIDINECARBOXYLIC ACID, SCHEMBL10643500, CTK8C4163, DTXSID50511474, AJKXOHPNDQHYDM-UHFFFAOYSA-N, KS-000007NK, 1598AC, ANW-71159, MFCD16610607, ZINC39316981, AKOS016008244, FCH1178416, PB25567, AJ-99761, AK104612, AS-34753, AX8238820, TC-159904, CS-0051945, FT-0764632, Q-3066, C7H6ClNO3, 2-Chloro-5-methoxynicotinicacid,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.004g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	187.579g/mol
Monoisotopic Mass	187.004g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number