ChemSpider 2D Image | 7-Chloro-3-(~2~H)hydroxy-5-phenyl(1-~2~H)-1,3-dihydro-2H-1,4-benzodiazepin-2-one | C15H9D2ClN2O2

7-Chloro-3-(2H)hydroxy-5-phenyl(1-2H)-1,3-dihydro-2H-1,4-benzodiazepin-2-one

  • Molecular FormulaC15H9D2ClN2O2
  • Average mass288.725 Da
  • Monoisotopic mass288.063446 Da
  • ChemSpider ID95748976

  • Non-standard isotope - Non-standard isotope

More details:

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

2H-1,4-Benzodiazepin-2-one, 7-chloro-1,3-dihydro-1-d-3-(hydroxy-d)-5-phenyl- [ACD/Index Name]
7-Chlor-3-(2H)hydroxy-5-phenyl(1-2H)-1,3-dihydro-2H-1,4-benzodiazepin-2-on [German] [ACD/IUPAC Name]
7-Chloro-3-(2H)hydroxy-5-phenyl(1-2H)-1,3-dihydro-2H-1,4-benzodiazepin-2-one [ACD/IUPAC Name]
7-Chloro-3-(2H)hydroxy-5-phényl(1-2H)-1,3-dihydro-2H-1,4-benzodiazépin-2-one [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 506.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 260.2±30.1 °C
Index of Refraction: 1.682
Molar Refractivity: 76.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.81
ACD/KOC (pH 5.5): 316.08
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 21.81
ACD/KOC (pH 7.4): 316.04
Polar Surface Area: 62 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 54.6±7.0 dyne/cm
Molar Volume: 201.9±7.0 cm3

Click to predict properties on the Chemicalize site


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