AG003GVU

133928-73-1 | 2-Chloro-3-methylisonicotinic acid

AG003GVU

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CAS Number	133928-73-1
Catalog Number	AG003GVU(AGN-PC-003NE8)
Chemical Name	2-Chloro-3-methylisonicotinic acid
IUPAC Name	2-chloro-3-methylpyridine-4-carboxylic acid
InChI	InChI=1S/C7H6ClNO2/c1-4-5(7(10)11)2-3-9-6(4)8/h2-3H,1H3,(H,10,11)
InChI Key	JYVLCHBMNCMRBO-UHFFFAOYSA-N
MDL Number	MFCD16610679
Molecular Formula	C7H6ClNO2
Molecular Weight	171.5810
SMILES	O=C(O)C1=CC=NC(Cl)=C1C
Synonyms	2-Chloro-3-methylisonicotinic acid, 133928-73-1, 2-CHLORO-3-METHYL-4-PYRIDINECARBOXYLIC ACID, 2-CHLORO-3-METHYLPYRIDINE-4-CARBOXYLIC ACID, SCHEMBL581067, CTK8B7323, KS-00000CSH, DTXSID60567866, JYVLCHBMNCMRBO-UHFFFAOYSA-N, 6142AA, ANW-57023, MFCD16610679, ZINC82046558, AKOS016002365, AB71250, ACN-040579, FCH1147507, TRA0174647, 2-CHLORO-3-METHYLISONICOTINICACID, AK-81020, AS-32277, SY019118, 2-Chloro-3-methyl-4-pyridinecarboxylicAcid, AB0065624, AJ-124253, AX8238668, DB-009937, TC-145768, CS-0040466, FT-0736238, ST24022122, 4-Pyridinecarboxylic acid, 2-chloro-3-methyl-, K-4215, MFCD16610679 (97+%), C7H6ClNO2,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.009g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	171.58g/mol
Monoisotopic Mass	171.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^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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