ChemSpider 2D Image | MFCD00070151 | C16H8D5ClN2O

MFCD00070151

  • Molecular FormulaC16H8D5ClN2O
  • Average mass289.771 Da
  • Monoisotopic mass289.103027 Da
  • ChemSpider ID24022455

  • Non-standard isotope - Non-standard isotope

More details:

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

200-659-6 [EINECS]
2H-1,4-Benzodiazepin-2-one, 7-chloro-1,3-dihydro-1-methyl-5-(phenyl-d5)- [ACD/Index Name]
65854-76-4 [RN]
7-Chlor-1-methyl-5-(2H5)phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-on [German] [ACD/IUPAC Name]
7-Chloro-1-methyl-5-(2H5)phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one [ACD/IUPAC Name]
7-Chloro-1-méthyl-5-(2H5)phényl-1,3-dihydro-2H-1,4-benzodiazépin-2-one [French] [ACD/IUPAC Name]
MFCD00070151
7-chloro-1-methyl-5-(2,3,4,5,6-pentadeuteriophenyl)-3H-1,4-benzodiazepin-2-one
Diazepam-D5
Diazepam-D5 0.1 mg/ml in Methanol
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 497.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 76.5±3.0 kJ/mol
    Flash Point: 254.6±28.7 °C
    Index of Refraction: 1.635
    Molar Refractivity: 80.9±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.91
    ACD/LogD (pH 5.5): 2.91
    ACD/BCF (pH 5.5): 96.31
    ACD/KOC (pH 5.5): 913.21
    ACD/LogD (pH 7.4): 2.92
    ACD/BCF (pH 7.4): 97.06
    ACD/KOC (pH 7.4): 920.27
    Polar Surface Area: 33 Å2
    Polarizability: 32.1±0.5 10-24cm3
    Surface Tension: 46.1±7.0 dyne/cm
    Molar Volume: 225.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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