ChemSpider 2D Image | 3-(2,2,2-Trifluoroethyl)azetidine | C5H8F3N

3-(2,2,2-Trifluoroethyl)azetidine

  • Molecular FormulaC5H8F3N
  • Average mass139.119 Da
  • Monoisotopic mass139.060883 Da
  • ChemSpider ID48216477

More details:

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

3-(2,2,2-Trifluorethyl)azetidin [German] [ACD/IUPAC Name]
3-(2,2,2-Trifluoroethyl)azetidine [ACD/IUPAC Name]
3-(2,2,2-Trifluoroéthyl)azétidine [French] [ACD/IUPAC Name]
Azetidine, 3-(2,2,2-trifluoroethyl)- [ACD/Index Name]
1394116-60-9 [RN]
3-(2,2,2-trifluoroethyl)azetidine(wxfc0683)
MFCD27920462

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 88.2±35.0 °C at 760 mmHg
    Vapour Pressure: 61.7±0.2 mmHg at 25°C
    Enthalpy of Vaporization: 32.8±3.0 kJ/mol
    Flash Point: 7.2±25.9 °C
    Index of Refraction: 1.364
    Molar Refractivity: 27.0±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.54
    ACD/LogD (pH 5.5): -2.10
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.76
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 12 Å2
    Polarizability: 10.7±0.5 10-24cm3
    Surface Tension: 21.6±3.0 dyne/cm
    Molar Volume: 121.0±3.0 cm3

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