ChemSpider 2D Image | 2-Chlorodibenzo[b,f]oxepine | C14H9ClO

2-Chlorodibenzo[b,f]oxepine

  • Molecular FormulaC14H9ClO
  • Average mass228.674 Da
  • Monoisotopic mass228.034195 Da
  • ChemSpider ID29211713

More details:

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

25558-88-7 [RN]
2-Chlordibenzo[b,f]oxepin [German] [ACD/IUPAC Name]
2-Chlorodibenzo[b,f]oxepine [ACD/IUPAC Name]
2-Chlorodibenzo[b,f]oxépine [French] [ACD/IUPAC Name]
Dibenz[b,f]oxepin, 2-chloro- [ACD/Index Name]
(R,E)-1-chloro-3-((4-chlorobenzylidene)amino)propan-2-ol
[25558-88-7] [RN]
3-chlorobenzo[b][1]benzoxepine
CS-13867
MFCD22124643 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 349.5±41.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.1±3.0 kJ/mol
    Flash Point: 165.0±21.7 °C
    Index of Refraction: 1.635
    Molar Refractivity: 64.5±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 1
    ACD/LogP: 5.49
    ACD/LogD (pH 5.5): 4.99
    ACD/BCF (pH 5.5): 3639.93
    ACD/KOC (pH 5.5): 12320.40
    ACD/LogD (pH 7.4): 4.99
    ACD/BCF (pH 7.4): 3639.93
    ACD/KOC (pH 7.4): 12320.40
    Polar Surface Area: 9 Å2
    Polarizability: 25.6±0.5 10-24cm3
    Surface Tension: 49.9±3.0 dyne/cm
    Molar Volume: 180.1±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement