AG00HAR5

1060805-13-1 | 6-bromo-4-methoxypyridine-2-carboxylic acid

AG00HAR5

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CAS Number	1060805-13-1
Catalog Number	AG00HAR5(AGN-PC-0CDXKO)
Chemical Name	6-bromo-4-methoxypyridine-2-carboxylic acid
IUPAC Name	6-bromo-4-methoxypyridine-2-carboxylic acid
InChI	InChI=1S/C7H6BrNO3/c1-12-4-2-5(7(10)11)9-6(8)3-4/h2-3H,1H3,(H,10,11)
InChI Key	UCVPDRVYDNGOIX-UHFFFAOYSA-N
MDL Number	MFCD13189165
Molecular Formula	C7H6BrNO3
Molecular Weight	232.0314
SMILES	O=C(O)C1=NC(Br)=CC(OC)=C1
Synonyms	6-BROMO-4-METHOXYPICOLINIC ACID, 1060805-13-1, SCHEMBL1424927, UCVPDRVYDNGOIX-UHFFFAOYSA-N, MFCD13189165, ZINC84312941, AB67867, FCH1381164, AK151000, AJ-126265, AX8287896, 6-bromo-4-methoxypyridine-2-carboxylic acid, 2-Pyridinecarboxylic acid, 6-bromo-4-methoxy-, 6-BROMO-4-METHOXY-PYRIDINE-2-CARBOXYLIC ACID,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	230.953g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	232.033g/mol
Monoisotopic Mass	230.953g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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