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1197943-94-4 | 2H-Indazole-5-carboxylic acid, 2-methyl-
CAS No: 1197943-94-4 Catalog No: AG000PMT MDL No:MFCD15071450
Product Description
Catalog Number:
AG000PMT
Chemical Name:
2H-Indazole-5-carboxylic acid, 2-methyl-
CAS Number:
1197943-94-4
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD15071450
IUPAC Name:
2-methylindazole-5-carboxylic acid
InChI:
InChI=1S/C9H8N2O2/c1-11-5-7-4-6(9(12)13)2-3-8(7)10-11/h2-5H,1H3,(H,12,13)
InChI Key:
HNFGGBMTWQVAED-UHFFFAOYSA-N
SMILES:
Cn1nc2c(c1)cc(cc2)C(=O)O
Properties
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
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