ChemSpider 2D Image | 1-Ethyl-4-(3,3,3-trifluoropropyl)benzene | C11H13F3

1-Ethyl-4-(3,3,3-trifluoropropyl)benzene

  • Molecular FormulaC11H13F3
  • Average mass202.216 Da
  • Monoisotopic mass202.096939 Da
  • ChemSpider ID21436780

More details:

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

1099597-24-6 [RN]
1-Ethyl-4-(3,3,3-trifluoropropyl)benzene [ACD/IUPAC Name]
1-Éthyl-4-(3,3,3-trifluoropropyl)benzène [French] [ACD/IUPAC Name]
1-Ethyl-4-(3,3,3-trifluorpropyl)benzol [German] [ACD/IUPAC Name]
Benzene, 1-ethyl-4-(3,3,3-trifluoropropyl)- [ACD/Index Name]
MFCD11226586 [MDL number]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 198.0±40.0 °C at 760 mmHg
    Vapour Pressure: 0.5±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 41.6±3.0 kJ/mol
    Flash Point: 64.1±15.3 °C
    Index of Refraction: 1.449
    Molar Refractivity: 50.4±0.3 cm3
    #H bond acceptors: 0
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.24
    ACD/LogD (pH 5.5): 4.35
    ACD/BCF (pH 5.5): 1192.17
    ACD/KOC (pH 5.5): 5541.69
    ACD/LogD (pH 7.4): 4.35
    ACD/BCF (pH 7.4): 1192.17
    ACD/KOC (pH 7.4): 5541.69
    Polar Surface Area: 0 Å2
    Polarizability: 20.0±0.5 10-24cm3
    Surface Tension: 25.9±3.0 dyne/cm
    Molar Volume: 188.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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