ChemSpider 2D Image | 4-Fluoro-2-azabicyclo[2.1.1]hexane-1-carboxylic acid | C6H8FNO2

4-Fluoro-2-azabicyclo[2.1.1]hexane-1-carboxylic acid

  • Molecular FormulaC6H8FNO2
  • Average mass145.132 Da
  • Monoisotopic mass145.053909 Da
  • ChemSpider ID26055266

More details:

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

1196976-68-7 [RN]
2-Azabicyclo[2.1.1]hexane-1-carboxylic acid, 4-fluoro- [ACD/Index Name]
4-Fluor-2-azabicyclo[2.1.1]hexan-1-carbonsäure [German] [ACD/IUPAC Name]
4-Fluoro-2-azabicyclo[2.1.1]hexane-1-carboxylic acid [ACD/IUPAC Name]
Acide 4-fluoro-2-azabicyclo[2.1.1]hexane-1-carboxylique [French] [ACD/IUPAC Name]
1-fluoro-3-azabicyclo[2.1.1]hexane-4-carboxylic acid
MFCD12913296 [MDL number]
MFCD19160637 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 265.9±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 55.5±6.0 kJ/mol
    Flash Point: 114.6±27.3 °C
    Index of Refraction: 1.542
    Molar Refractivity: 31.2±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.40
    ACD/LogD (pH 5.5): -2.72
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.79
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 49 Å2
    Polarizability: 12.4±0.5 10-24cm3
    Surface Tension: 49.9±5.0 dyne/cm
    Molar Volume: 99.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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