ChemSpider 2D Image | 3,9-Dibenzyl-3,7,9-triazabicyclo[3.3.1]nonane | C20H25N3

3,9-Dibenzyl-3,7,9-triazabicyclo[3.3.1]nonane

  • Molecular FormulaC20H25N3
  • Average mass307.433 Da
  • Monoisotopic mass307.204834 Da
  • ChemSpider ID28579294

More details:

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

3,7,9-Triazabicyclo[3.3.1]nonane, 3,9-bis(phenylmethyl)- [ACD/Index Name]
3,9-Dibenzyl-3,7,9-triazabicyclo[3.3.1]nonan [German] [ACD/IUPAC Name]
3,9-Dibenzyl-3,7,9-triazabicyclo[3.3.1]nonane [ACD/IUPAC Name]
3,9-Dibenzyl-3,7,9-triazabicyclo[3.3.1]nonane [French] [ACD/IUPAC Name]
3,7,9-Triazabicyclo[3.3.1]nonane [ACD/Index Name] [ACD/IUPAC Name]
864448-31-7 [RN]
MFCD28501366

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 443.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.1±3.0 kJ/mol
    Flash Point: 236.1±23.4 °C
    Index of Refraction: 1.602
    Molar Refractivity: 94.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.63
    ACD/LogD (pH 5.5): -0.27
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 1.09
    ACD/BCF (pH 7.4): 1.56
    ACD/KOC (pH 7.4): 15.87
    Polar Surface Area: 19 Å2
    Polarizability: 37.5±0.5 10-24cm3
    Surface Tension: 45.6±3.0 dyne/cm
    Molar Volume: 275.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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