AG0014SW

1214334-70-9 | 2-Pyridinecarboxylic acid, 5-bromo-6-methoxy-

AG0014SW

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CAS Number	1214334-70-9
Catalog Number	AG0014SW(AGN-PC-09TPS9)
Chemical Name	2-Pyridinecarboxylic acid, 5-bromo-6-methoxy-
IUPAC Name	5-bromo-6-methoxypyridine-2-carboxylic acid
InChI	InChI=1S/C7H6BrNO3/c1-12-6-4(8)2-3-5(9-6)7(10)11/h2-3H,1H3,(H,10,11)
InChI Key	AIHBRPSPSCCVPH-UHFFFAOYSA-N
MDL Number	MFCD13185810
Molecular Formula	C7H6BrNO3
Molecular Weight	232.0314
SMILES	O=C(O)C1=NC(OC)=C(Br)C=C1
Synonyms	5-Bromo-6-methoxypicolinic acid, 1214334-70-9, 5-Bromo-6-methoxypyridine-2-carboxylic acid, AK100452, 2-Pyridinecarboxylic acid, 5-bromo-6-methoxy-, SCHEMBL1672188, CTK8C3546, DTXSID00704718, KS-00000QU6, 3836AA, ANW-70228, MFCD13185810, ZINC71256510, AKOS016002629, CS-W022332, DS-2238, FCH1380759, AB0059862, AJ-117727, AX8241401, DB-083553, TC-158973, 3-Bromo-2-methoxy-6-pyridinecarboxylic acid, FT-0746030, ST24023985, C7H6BrNO3, 5-Bromo-6-methoxypicolinicacid, 5-bromo-6-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	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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