Molecule structure of 7-Methyl-1H-indazole (CAS NO.3176-66-7):
IUPAC Name: 7-Methyl-1H-indazole
Molecular Weight: 132.16252 g/mol
Molecular Formula: C8H8N2
Density: 1.186 g/cm3
Boiling Point: 285.1 °C at 760 mmHg
Flash Point: 133.3 °C
Index of Refraction: 1.666
Molar Refractivity: 41.44 cm3
Molar Volume: 111.3 cm3
Polarizability: 16.42×10-24 cm3
Surface Tension: 54.4 dyne/cm
Enthalpy of Vaporization: 50.31 kJ/mol
Vapour Pressure: 0.00491 mmHg at 25 °C
XLogP3-AA: 1.9
H-Bond Donor: 1
H-Bond Acceptor: 1
Tautomer Count: 2
Exact Mass: 132.068748
MonoIsotopic Mass: 132.068748
Topological Polar Surface Area: 28.7
Heavy Atom Count: 10
Complexity: 124
Canonical SMILES: CC1=CC=CC2=C1NN=C2
InChI: InChI=1S/C8H8N2/c1-6-3-2-4-7-5-9-10-8(6)7/h2-5H,1H3,(H,9,10)
InChIKey: RLAZPAQEVQDPHR-UHFFFAOYSA-N
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