ChemSpider 2D Image | 1-(1,3-dimethylpyrazol-4-yl)-2,2-difluoroethanone | C7H8F2N2O

1-(1,3-dimethylpyrazol-4-yl)-2,2-difluoroethanone

  • Molecular FormulaC7H8F2N2O
  • Average mass174.148 Da
  • Monoisotopic mass174.060471 Da
  • ChemSpider ID21805219

More details:

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

1-(1,3-Dimethyl-1H-pyrazol-4-yl)-2,2-difluorethanon [German] [ACD/IUPAC Name]
1-(1,3-dimethyl-1H-pyrazol-4-yl)-2,2-difluoroethan-1-one
1-(1,3-Dimethyl-1H-pyrazol-4-yl)-2,2-difluoroethanone [ACD/IUPAC Name]
1-(1,3-Diméthyl-1H-pyrazol-4-yl)-2,2-difluoroéthanone [French] [ACD/IUPAC Name]
1-(1,3-dimethylpyrazol-4-yl)-2,2-difluoroethanone
1174846-40-2 [RN]
Ethanone, 1-(1,3-dimethyl-1H-pyrazol-4-yl)-2,2-difluoro- [ACD/Index Name]
1-(1,3-dimethylpyrazol-4-yl)-2,2-difluoroethan-1-one
1-(1,3-dimethylpyrazol-4-yl)-2,2-difluoro-ethanone
AGN-PC-07E36V
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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: 244.2±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 48.1±3.0 kJ/mol
    Flash Point: 101.5±25.9 °C
    Index of Refraction: 1.503
    Molar Refractivity: 39.5±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.31
    ACD/LogD (pH 5.5): 0.73
    ACD/BCF (pH 5.5): 2.11
    ACD/KOC (pH 5.5): 59.45
    ACD/LogD (pH 7.4): 0.73
    ACD/BCF (pH 7.4): 2.11
    ACD/KOC (pH 7.4): 59.45
    Polar Surface Area: 35 Å2
    Polarizability: 15.7±0.5 10-24cm3
    Surface Tension: 30.8±7.0 dyne/cm
    Molar Volume: 133.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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