ChemSpider 2D Image | 6,6-Dimethyl-3-(trifluoromethyl)-1,5,6,7-tetrahydro-4H-indazol-4-one | C10H11F3N2O

6,6-Dimethyl-3-(trifluoromethyl)-1,5,6,7-tetrahydro-4H-indazol-4-one

  • Molecular FormulaC10H11F3N2O
  • Average mass232.202 Da
  • Monoisotopic mass232.082352 Da
  • ChemSpider ID26051765

More details:

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

4H-Indazol-4-one, 1,5,6,7-tetrahydro-6,6-dimethyl-3-(trifluoromethyl)- [ACD/Index Name]
6,6-Dimethyl-3-(trifluormethyl)-1,5,6,7-tetrahydro-4H-indazol-4-on [German] [ACD/IUPAC Name]
6,6-Dimethyl-3-(trifluoromethyl)-1,5,6,7-tetrahydro-4H-indazol-4-one [ACD/IUPAC Name]
6,6-Diméthyl-3-(trifluorométhyl)-1,5,6,7-tétrahydro-4H-indazol-4-one [French] [ACD/IUPAC Name]
908111-34-2 [RN]
[908111-34-2] [RN]
6,6-Dimethyl-1,5,6,7-tetrahydro-3-(trifluoromethyl)-4H-indazol-4-one
6,6-dimethyl-3-(trifluoromethyl)-1H-5,6,7-trihydroindazol-4-one
6,6-dimethyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-4-one
6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1H-indazol-4-one
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 333.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.7±3.0 kJ/mol
    Flash Point: 155.7±27.9 °C
    Index of Refraction: 1.479
    Molar Refractivity: 50.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.72
    ACD/LogD (pH 5.5): 2.62
    ACD/BCF (pH 5.5): 57.43
    ACD/KOC (pH 5.5): 631.83
    ACD/LogD (pH 7.4): 2.57
    ACD/BCF (pH 7.4): 51.37
    ACD/KOC (pH 7.4): 565.17
    Polar Surface Area: 46 Å2
    Polarizability: 19.8±0.5 10-24cm3
    Surface Tension: 36.5±3.0 dyne/cm
    Molar Volume: 176.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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