ChemSpider 2D Image | Methyl 4,5,6,7-tetrahydro-1H-indazole-3-carboxylate | C9H12N2O2

Methyl 4,5,6,7-tetrahydro-1H-indazole-3-carboxylate

  • Molecular FormulaC9H12N2O2
  • Average mass180.204 Da
  • Monoisotopic mass180.089874 Da
  • ChemSpider ID28823976

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-Indazole-3-carboxylic acid, 4,5,6,7-tetrahydro-, methyl ester [ACD/Index Name]
32286-98-9 [RN]
4,5,6,7-Tétrahydro-1H-indazole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4,5,6,7-tetrahydro-1H-indazole-3-carboxylate [ACD/IUPAC Name]
Methyl-4,5,6,7-tetrahydro-1H-indazol-3-carboxylat [German] [ACD/IUPAC Name]
4,5,6,7-tetrahydro-1(2)H-indazole-3-carboxylic acid methyl ester
4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid methyl ester
methyl 4,5,6,7-tetrahydro-2H-indazole-3-carboxylate
MFCD16620163

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 398.3±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.9±3.0 kJ/mol
    Flash Point: 194.7±27.9 °C
    Index of Refraction: 1.563
    Molar Refractivity: 47.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.78
    ACD/LogD (pH 5.5): 2.07
    ACD/BCF (pH 5.5): 22.17
    ACD/KOC (pH 5.5): 319.85
    ACD/LogD (pH 7.4): 2.07
    ACD/BCF (pH 7.4): 22.17
    ACD/KOC (pH 7.4): 319.88
    Polar Surface Area: 55 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 52.5±3.0 dyne/cm
    Molar Volume: 145.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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