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Basic Information
CAS No.: 1201-24-7
Name: 5-Methyl-1H-indazole-3-carboxylic acid
Article Data: 8
Molecular Structure:
Molecular Structure of 1201-24-7 (5-Methyl-1H-indazole-3-carboxylic acid)
Formula: C9H8N2O2
Molecular Weight: 176.17
Synonyms: 5-Methylindazole-3-carboxylic acid;
Density: 1.422 g/cm3
Melting Point: 343 °C
Boiling Point: 443.27 °C at 760 mmHg
Flash Point: 221.882 °C
Risk Codes: R36/37/38
PSA: 65.98000
LogP: 1.56950
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Chemistry


IUPAC Name: 5-Methyl-1H-indazole-3-carboxylic acid
Molecular Formula: C9H8N2O2
Molecular Weight: 176.17 g/mol
Canonical SMILES: [nH]1nc(c2cc(ccc12)C)C(=O)O
InChI: InChI=1/C9H8N2O2/c1-5-2-3-7-6(4-5)8(9(12)13)11-10-7/h2-4H,1H3,(H,10,11)(H,12,13)
Mol File: 1201-24-7.mol
Product Categories: Indazole; API intermediates
XLogP3-AA: 1.8
H-Bond Donor: 2
H-Bond Acceptor: 3
Rotatable Bond Count: 1
Tautomer Count: 6
Exact Mass: 176.058578
MonoIsotopic Mass: 176.058578
Topological Polar Surface Area: 66
Heavy Atom Count: 13
Complexity: 220
Index of Refraction: 1.709
Molar Refractivity: 48.37 cm3
Molar Volume: 123.9 cm3
Polarizability: 19.17×10-24cm3
Surface Tension: 75 dyne/cm
Density: 1.421 g/cm3
Flash Point: 221.9 °C
Enthalpy of Vaporization: 73.87 kJ/mol
Boiling Point: 443.3 °C at 760 mmHg
Vapour Pressure of 5-Methyl-1H-indazole-3-carboxylic acid (CAS NO.1201-24-7): 1.23E-08 mmHg at 25 °C

Safety Profile

HazardClass of 5-Methyl-1H-indazole-3-carboxylic acid (CAS NO.1201-24-7): Irritant

Specification

  5-Methyl-1H-indazole-3-carboxylic acid (CAS NO.1201-24-7), its Synonyms are 1H-Indazole-3-carboxylic acid, 5-methyl- ; 5-Methylindazole-3-carboxylic acid ; 5-Methyl-3-(1H)indazole carboxylic acid .