AG00924S

1031417-41-0 | 7-methyl-1H-indazole-5-carboxylic acid

AG00924S

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CAS Number	1031417-41-0
Catalog Number	AG00924S(AGN-PC-0WAN3H)
Chemical Name	7-methyl-1H-indazole-5-carboxylic acid
IUPAC Name	7-methyl-1H-indazole-5-carboxylic acid
InChI	InChI=1S/C9H8N2O2/c1-5-2-6(9(12)13)3-7-4-10-11-8(5)7/h2-4H,1H3,(H,10,11)(H,12,13)
InChI Key	XMVNTKZCEKCKQD-UHFFFAOYSA-N
MDL Number	MFCD14585353
Molecular Formula	C9H8N2O2
Molecular Weight	176.1720
SMILES	Cc1c2c(cc(c1)C(=O)O)cn[nH]2
Synonyms	7-METHYL-1H-INDAZOLE-5-CARBOXYLIC ACID, 1031417-41-0, AK137222, SCHEMBL551333, KS-00000RPI, DTXSID70696318, XMVNTKZCEKCKQD-UHFFFAOYSA-N, 3727AJ, MFCD14585353, ZINC40449975, AKOS022172079, AN-2497, DS-2993, FCH1186849, SB16406, BP-11762, OR322740, SC-93523, SY103695, AJ-103199, AX8258790, ST2406579, 4CH-017015, CS-0054508, MFCD14585353 (95%), C9H8N2O2,

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	2
Isotope Atom Count	0
Molecular Weight	176.175g/mol
Monoisotopic Mass	176.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number