ChemSpider 2D Image | 3-Chloro-10,11-dihydro-5H-dibenzo azepine | C14H12ClN

3-Chloro-10,11-dihydro-5H-dibenzo azepine

  • Molecular FormulaC14H12ClN
  • Average mass229.705 Da
  • Monoisotopic mass229.065826 Da
  • ChemSpider ID32820802

More details:

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

39607-90-4 [RN]
3-Chlor-10,11-dihydro-5H-dibenzo[b,d]azepin [German] [ACD/IUPAC Name]
3-Chloro-10,11-dihydro-5H-dibenzo azepine
3-Chloro-10,11-dihydro-5H-dibenzo[b,d]azepine [ACD/IUPAC Name]
3-Chloro-10,11-dihydro-5H-dibenzo[b,d]azépine [French] [ACD/IUPAC Name]
5-chloro-8-azatricyclo[9.4.0.0²,?]pentadeca-1(11),2,4,6,9,12-hexaene
5H-Dibenz[b,d]azepine, 3-chloro-10,11-dihydro- [ACD/Index Name]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 412.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.5±3.0 kJ/mol
    Flash Point: 203.3±28.7 °C
    Index of Refraction: 1.664
    Molar Refractivity: 67.5±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 3.58
    ACD/LogD (pH 5.5): 3.69
    ACD/BCF (pH 5.5): 377.61
    ACD/KOC (pH 5.5): 2433.57
    ACD/LogD (pH 7.4): 3.69
    ACD/BCF (pH 7.4): 377.64
    ACD/KOC (pH 7.4): 2433.74
    Polar Surface Area: 12 Å2
    Polarizability: 26.7±0.5 10-24cm3
    Surface Tension: 50.2±5.0 dyne/cm
    Molar Volume: 181.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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