ChemSpider 2D Image | 8-Oxa-3-azabicyclo[3.2.1]octane | C6H11NO

8-Oxa-3-azabicyclo[3.2.1]octane

  • Molecular FormulaC6H11NO
  • Average mass113.158 Da
  • Monoisotopic mass113.084061 Da
  • ChemSpider ID24602543

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,5S)-8-Oxa-3-azabicyclo[3.2.1]octan [German] [ACD/IUPAC Name]
(1R,5S)-8-Oxa-3-azabicyclo[3.2.1]octane [ACD/IUPAC Name]
(1R,5S)-8-Oxa-3-azabicyclo[3.2.1]octane [French] [ACD/IUPAC Name]
8-Oxa-3-azabicyclo[3.2.1]octane [ACD/Index Name] [ACD/IUPAC Name]
8-Oxa-3-azabicyclo[3.2.1]octane, (1R,5S)- [ACD/Index Name]
MFCD09836264 [MDL number]
(1R,5S)-8-oxa-3-aza-bicyclo[3.2.1]octane
280-13-7 [RN]
8-oxa-3-aza-bicyclo[3.2.1]octane

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 176.6±15.0 °C at 760 mmHg
    Vapour Pressure: 1.1±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 41.3±3.0 kJ/mol
    Flash Point: 58.6±9.8 °C
    Index of Refraction: 1.470
    Molar Refractivity: 30.7±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -0.66
    ACD/LogD (pH 5.5): -3.24
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.05
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 21 Å2
    Polarizability: 12.2±0.5 10-24cm3
    Surface Tension: 34.4±3.0 dyne/cm
    Molar Volume: 110.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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