AG003A9L

1176754-31-6 | 1-methyl-1H-indazole-5-carboxylic acid

AG003A9L

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CAS Number	1176754-31-6
Catalog Number	AG003A9L(AGN-PC-0WA4NZ)
Chemical Name	1-methyl-1H-indazole-5-carboxylic acid
IUPAC Name	1-methylindazole-5-carboxylic acid
InChI	InChI=1S/C9H8N2O2/c1-11-8-3-2-6(9(12)13)4-7(8)5-10-11/h2-5H,1H3,(H,12,13)
InChI Key	VWIWCHCBXWBREL-UHFFFAOYSA-N
MDL Number	MFCD11901714
Molecular Formula	C9H8N2O2
Molecular Weight	176.1720
SMILES	O=C(C1=CC2=C(N(C)N=C2)C=C1)O
Synonyms	1-METHYL-1H-INDAZOLE-5-CARBOXYLIC ACID, 1176754-31-6, 1-METHYL-INDAZOLE-5-CARBOXYLIC ACID, 1-methylindazole-5-carboxylic acid, 1-Methylbenzodiazole-5-carboxylic acid, AK153286, J-504883, W-204954, 1H-Indazole-5-carboxylicacid,1-methyl-, ACMC-209l7y, SCHEMBL1144709, DTXSID80653457, VWIWCHCBXWBREL-UHFFFAOYSA-N, 1-methyl-5-indazolecarboxylic acid, KS-000003AH, ANW-31772, MFCD11901714, ZINC31892956, AKOS015949489, FCH1165269, GS-6372, PB34649, RP02976, AJ-84439, AB0039676, AX8167801, DB-023360, ST1100548, TC-120517, AM20020260, CS-0052467, FT-0684654, Y7176, C-2352, 1H-INDAZOLE-5-CARBOXYLIC ACID, 1-METHYL-, A803813, C9H8N2O2, ACN-045186, 1-methyl-1H-indazole-5-carboxylic acid, 95% - 1G 1g, 53484-17-6,

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	1.1

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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