ChemSpider 2D Image | 3-(Trifluoromethyl)bicyclo[1.1.1]pentan-1-ol | C6H7F3O

3-(Trifluoromethyl)bicyclo[1.1.1]pentan-1-ol

  • Molecular FormulaC6H7F3O
  • Average mass152.114 Da
  • Monoisotopic mass152.044907 Da
  • ChemSpider ID24189122

More details:

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

3-(Trifluormethyl)bicyclo[1.1.1]pentan-1-ol [German] [ACD/IUPAC Name]
3-(Trifluoromethyl)bicyclo[1.1.1]pentan-1-ol [ACD/IUPAC Name]
3-(Trifluorométhyl)bicyclo[1.1.1]pentan-1-ol [French] [ACD/IUPAC Name]
Bicyclo[1.1.1]pentan-1-ol, 3-(trifluoromethyl)- [ACD/Index Name]
585532-19-0 [RN]
95%
Bicyclo[1.1.1]pentan-1-ol, 3-(trifluoromethyl)- (9CI)
BICYCLO[1.1.1]PENTAN-1-OL,3-(TRIFLUOROMETHYL)-
MFCD18826719

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 111.0±35.0 °C at 760 mmHg
    Vapour Pressure: 12.1±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 40.8±6.0 kJ/mol
    Flash Point: 47.6±20.4 °C
    Index of Refraction: 1.523
    Molar Refractivity: 27.3±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.60
    ACD/LogD (pH 5.5): 0.89
    ACD/BCF (pH 5.5): 2.79
    ACD/KOC (pH 5.5): 72.54
    ACD/LogD (pH 7.4): 0.89
    ACD/BCF (pH 7.4): 2.79
    ACD/KOC (pH 7.4): 72.54
    Polar Surface Area: 20 Å2
    Polarizability: 10.8±0.5 10-24cm3
    Surface Tension: 56.2±3.0 dyne/cm
    Molar Volume: 89.3±3.0 cm3

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