AG0073ZN

1211515-68-2 | 3-Bromo-5-methylpicolinic acid

AG0073ZN

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CAS Number	1211515-68-2
Catalog Number	AG0073ZN(AGN-PC-09SH44)
Chemical Name	3-Bromo-5-methylpicolinic acid
IUPAC Name	3-bromo-5-methylpyridine-2-carboxylic acid
InChI	InChI=1S/C7H6BrNO2/c1-4-2-5(8)6(7(10)11)9-3-4/h2-3H,1H3,(H,10,11)
InChI Key	BAFGEDISONEYIX-UHFFFAOYSA-N
MDL Number	MFCD17214206
Molecular Formula	C7H6BrNO2
Molecular Weight	216.0320
SMILES	O=C(O)C1=NC=C(C)C=C1Br
Synonyms	3-Bromo-5-methylpicolinic acid, 1211515-68-2, 3-Bromo-5-methylpyridine-2-carboxylic acid, AK-76925, W-205109, SCHEMBL14555730, CTK8B5482, DTXSID50694175, BAFGEDISONEYIX-UHFFFAOYSA-N, KS-00000PJ9, ZX-AT003538, 3-Bromo-2-carboxy-5-methylpyridine, ANW-48890, MFCD17214206, ZINC66322851, AKOS015920270, FCH1358431, FS-3419, OR60145, RP04985, BR-76925, DA-19266, SY031478, 3-Bromo-5-methyl-2-pyridinecarboxylic acid, AB0035189, AJ-115898, AX8223454, TC-137635, 4CH-011216, FT-0763122, ST24022755, X9475, MFCD17214206 (95%), C-2558, J-512042, C7H6BrNO2, 3-Bromo-5-methylpicolinicacid, 3-bromo-5-methylpyridine-2-carboxylic acid, 95% - 1G 1g,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.958g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.034g/mol
Monoisotopic Mass	214.958g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H332-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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