ChemSpider 2D Image | 3-Benzyl-3-azabicyclo[3.1.1]heptan-6-one | C13H15NO

3-Benzyl-3-azabicyclo[3.1.1]heptan-6-one

  • Molecular FormulaC13H15NO
  • Average mass201.264 Da
  • Monoisotopic mass201.115356 Da
  • ChemSpider ID26053549

More details:

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

1240529-14-9 [RN]
3-Azabicyclo[3.1.1]heptan-6-one, 3-(phenylmethyl)- [ACD/Index Name]
3-Benzyl-3-azabicyclo[3.1.1]heptan-6-on [German] [ACD/IUPAC Name]
3-Benzyl-3-azabicyclo[3.1.1]heptan-6-one [ACD/IUPAC Name]
3-Benzyl-3-azabicyclo[3.1.1]heptan-6-one [French] [ACD/IUPAC Name]
24522-49-4 [RN]
3-benzyl-3-azabicyclo(3.1.1)heptan-6-one
3-Benzyl-3-aza-bicyclo[3.1.1]heptan-6-one
3-benzyl-3-azabicyclo[3.1.1]heptan-6-one(wx120448)
3-benzyl-3-aza-bicyclo3.1.1heptan-6-one
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 326.6±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.9±3.0 kJ/mol
    Flash Point: 141.7±11.9 °C
    Index of Refraction: 1.601
    Molar Refractivity: 58.6±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.04
    ACD/LogD (pH 5.5): 0.20
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.80
    ACD/LogD (pH 7.4): 1.61
    ACD/BCF (pH 7.4): 8.93
    ACD/KOC (pH 7.4): 149.21
    Polar Surface Area: 20 Å2
    Polarizability: 23.2±0.5 10-24cm3
    Surface Tension: 49.0±3.0 dyne/cm
    Molar Volume: 171.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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