AG00389W

1031417-77-2 | 1-methyl-1H-indazole-6-carboxylic acid

AG00389W

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CAS Number	1031417-77-2
Catalog Number	AG00389W(AGN-PC-0WBOHI)
Chemical Name	1-methyl-1H-indazole-6-carboxylic acid
IUPAC Name	1-methylindazole-6-carboxylic acid
InChI	InChI=1S/C9H8N2O2/c1-11-8-4-6(9(12)13)2-3-7(8)5-10-11/h2-5H,1H3,(H,12,13)
InChI Key	DNMTXRJELGPOGW-UHFFFAOYSA-N
MDL Number	MFCD11043008
Molecular Formula	C9H8N2O2
Molecular Weight	176.1720
SMILES	CN1N=CC2=CC=C(C=C12)C(=O)O
Synonyms	1-METHYL-1H-INDAZOLE-6-CARBOXYLIC ACID, 1031417-77-2, 1-METHYLINDAZOLE-6-CARBOXYLIC ACID, J-504886, W-204483, 1H-Indazole-6-carboxylicacid,1-methyl-, SCHEMBL1759304, CTK8B7193, DTXSID60617714, KS-000003AN, ANW-56678, FCH886994, MFCD11043008, ZINC44682160, AKOS006307054, PB28199, RP02973, AK-78096, AS-30599, DA-19251, SY065572, 1H-Indazole-6-carboxylic acid, 1-methyl-, AB0039400, AJ-109922, AX8222155, ST1100557, TC-145423, CS-0046211, FT-0730377, Y6858, MFCD11043008 (95%), C-2197, F1907-1516, C9H8N2O2, 1-methyl-1H-indazole-6-carboxylic acid, 95% - 1G 1g,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.059g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.175g/mol
Monoisotopic Mass	176.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	55.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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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