ChemSpider 2D Image | [3-(Trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]acetonitrile | C10H10F3N3

[3-(Trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]acetonitrile

  • Molecular FormulaC10H10F3N3
  • Average mass229.202 Da
  • Monoisotopic mass229.082687 Da
  • ChemSpider ID53622391

More details:

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

[3-(Trifluormethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]acetonitril [German] [ACD/IUPAC Name]
[3-(Trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]acetonitrile [ACD/IUPAC Name]
[3-(Trifluorométhyl)-4,5,6,7-tétrahydro-1H-indazol-1-yl]acétonitrile [French] [ACD/IUPAC Name]
1H-Indazole-1-acetonitrile, 4,5,6,7-tetrahydro-3-(trifluoromethyl)- [ACD/Index Name]
2-(3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl)acetonitrile
2098008-55-8 [RN]
MFCD30010320

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 308.1±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 54.9±3.0 kJ/mol
    Flash Point: 140.1±27.9 °C
    Index of Refraction: 1.559
    Molar Refractivity: 52.6±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.30
    ACD/LogD (pH 5.5): 2.45
    ACD/BCF (pH 5.5): 43.16
    ACD/KOC (pH 5.5): 515.24
    ACD/LogD (pH 7.4): 2.45
    ACD/BCF (pH 7.4): 43.16
    ACD/KOC (pH 7.4): 515.24
    Polar Surface Area: 42 Å2
    Polarizability: 20.9±0.5 10-24cm3
    Surface Tension: 39.0±7.0 dyne/cm
    Molar Volume: 163.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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