AG0013TU

137778-20-2 | 2-Pyridinecarboxylic acid, 5-bromo-6-methyl-

AG0013TU

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CAS Number	137778-20-2
Catalog Number	AG0013TU(AGN-PC-003Q4S)
Chemical Name	2-Pyridinecarboxylic acid, 5-bromo-6-methyl-
IUPAC Name	5-bromo-6-methylpyridine-2-carboxylic acid
InChI	InChI=1S/C7H6BrNO2/c1-4-5(8)2-3-6(9-4)7(10)11/h2-3H,1H3,(H,10,11)
InChI Key	UXKSXZKZOWOMKC-UHFFFAOYSA-N
MDL Number	MFCD13181588
Molecular Formula	C7H6BrNO2
Molecular Weight	216.0320
SMILES	O=C(O)C1=NC(C)=C(Br)C=C1
Synonyms	5-Bromo-6-methylpicolinic acid, 137778-20-2, 5-BROMO-6-METHYLPYRIDINE-2-CARBOXYLIC ACID, 3-Bromo-2-methylpyridine-6-carboxylic acid, 2-Pyridinecarboxylic acid, 5-bromo-6-methyl-, AK-61563, SCHEMBL1425108, CTK7I7780, DTXSID60568131, UXKSXZKZOWOMKC-UHFFFAOYSA-N, KS-00000P4M, MFCD13181588, ZINC59025098, AKOS022173753, CS-W007046, FCH1380402, OR52563, DS-14788, SC-52579, AJ-113196, AX8217951, 4CH-023603, 5-Bromo-6-methyl-2-pyridine carboxylic acid, ST24044514, Z0162, Q-7611, 5-Bromo-6-methyl-2-pyridinecarboxylic acid, AldrichCPR, C7H6BrNO2,

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

Certificate of Analysis

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