ChemSpider 2D Image | 10-Benzyl-10-azatricyclo[6.3.1.0~2,7~]dodeca-2,4,6-triene | C18H19N

10-Benzyl-10-azatricyclo[6.3.1.02,7]dodeca-2,4,6-triene

  • Molecular FormulaC18H19N
  • Average mass249.350 Da
  • Monoisotopic mass249.151749 Da
  • ChemSpider ID10608769

More details:

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

1,5-Methano-1H-3-benzazepine, 2,3,4,5-tetrahydro-3-(phenylmethyl)- [ACD/Index Name]
10-Benzyl-10-azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien [German] [ACD/IUPAC Name]
10-Benzyl-10-azatricyclo[6.3.1.02,7]dodeca-2,4,6-triene [ACD/IUPAC Name]
10-Benzyl-10-azatricyclo[6.3.1.02,7]dodéca-2,4,6-triène [French] [ACD/IUPAC Name]
230615-48-2 [RN]
3-Benzyl-2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine
[230615-48-2] [RN]
1,5-Methano-1H-3-benzazepine,2,3,4,5-tetrahydro-3-(phenylmethyl)-
2,3,4,5-Tetrahydro-3-(phenylmethyl)-1,5-methano-1H-3-benzazepine
3-Benzyl-2,3,4,5-tetrahydro-1H-1,5-methano-3-benzazepine
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 374.5±11.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.2±3.0 kJ/mol
    Flash Point: 162.1±16.2 °C
    Index of Refraction: 1.624
    Molar Refractivity: 78.4±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.98
    ACD/LogD (pH 5.5): 1.65
    ACD/BCF (pH 5.5): 2.93
    ACD/KOC (pH 5.5): 16.33
    ACD/LogD (pH 7.4): 3.36
    ACD/BCF (pH 7.4): 148.76
    ACD/KOC (pH 7.4): 828.49
    Polar Surface Area: 3 Å2
    Polarizability: 31.1±0.5 10-24cm3
    Surface Tension: 46.3±3.0 dyne/cm
    Molar Volume: 222.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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