ChemSpider 2D Image | (1R,5S,6R)-N,N-dibenzyl-3-azabicyclo[3.1.0]hexan-6-amine | C19H22N2

(1R,5S,6R)-N,N-dibenzyl-3-azabicyclo[3.1.0]hexan-6-amine

  • Molecular FormulaC19H22N2
  • Average mass278.391 Da
  • Monoisotopic mass278.178314 Da
  • ChemSpider ID24723202

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1R,5S,6R)-N,N-dibenzyl-3-azabicyclo[3.1.0]hexan-6-amine [ACD/IUPAC Name]
(1R,5S,6s)-N,N-Dibenzyl-3-azabicyclo[3.1.0]hexan-6-amin [German] [ACD/IUPAC Name]
(1R,5S,6s)-N,N-Dibenzyl-3-azabicyclo[3.1.0]hexan-6-amine [ACD/IUPAC Name]
(1R,5S,6s)-N,N-Dibenzyl-3-azabicyclo[3.1.0]hexan-6-amine [French] [ACD/IUPAC Name]
210482-10-3 [RN]
3-Azabicyclo[3.1.0]hexan-6-amine, N,N-bis(phenylmethyl)-, (1R,5S)- [ACD/Index Name]
(1R,5S,6s)-rel-N,N-Dibenzyl-3-azabicyclo[3.1.0]hexan-6-amine
[210482-10-3] [RN]
3-Azabicyclo[3.1.0]hexan-6-amine [ACD/Index Name] [ACD/IUPAC Name]
3-Azabicyclo[3.1.0]hexan-6-amine, N,N-bis(phenylmethyl)-, (1a,5a,6a)- (9CI)
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 401.2±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.2±3.0 kJ/mol
    Flash Point: 153.6±18.3 °C
    Index of Refraction: 1.636
    Molar Refractivity: 87.3±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.34
    ACD/LogD (pH 5.5): 0.46
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.47
    ACD/LogD (pH 7.4): 0.87
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.79
    Polar Surface Area: 15 Å2
    Polarizability: 34.6±0.5 10-24cm3
    Surface Tension: 50.2±5.0 dyne/cm
    Molar Volume: 243.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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