ChemSpider 2D Image | 7-Chloro-1-methyl-5-(~2~H_5_)phenyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione | C16H8D5ClN2O2

7-Chloro-1-methyl-5-(2H5)phenyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione

  • Molecular FormulaC16H8D5ClN2O2
  • Average mass305.770 Da
  • Monoisotopic mass305.097931 Da
  • ChemSpider ID48058124

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7-chloro-1-methyl-5-(phenyl-d5)- [ACD/Index Name]
7-Chlor-1-methyl-5-(2H5)phenyl-1H-1,5-benzodiazepin-2,4(3H,5H)-dion [German] [ACD/IUPAC Name]
7-Chloro-1-methyl-5-(2H5)phenyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione [ACD/IUPAC Name]
7-Chloro-1-méthyl-5-(2H5)phényl-1H-1,5-benzodiazépine-2,4(3H,5H)-dione [French] [ACD/IUPAC Name]
129973-76-8 [RN]
7-chloro-1-methyl-5-(2,3,4,5,6-pentadeuteriophenyl)-1,5-benzodiazepine-2,4-dione

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 643.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.0±3.0 kJ/mol
    Flash Point: 343.2±31.5 °C
    Index of Refraction: 1.627
    Molar Refractivity: 79.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.69
    ACD/LogD (pH 5.5): 2.29
    ACD/BCF (pH 5.5): 32.20
    ACD/KOC (pH 5.5): 417.66
    ACD/LogD (pH 7.4): 2.26
    ACD/BCF (pH 7.4): 30.27
    ACD/KOC (pH 7.4): 392.62
    Polar Surface Area: 41 Å2
    Polarizability: 31.7±0.5 10-24cm3
    Surface Tension: 52.6±3.0 dyne/cm
    Molar Volume: 225.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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