ChemSpider 2D Image | 8-Chloro-6-[2-fluoro(~2~H_4_)phenyl]-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine | C18H9D4ClFN3

8-Chloro-6-[2-fluoro(2H4)phenyl]-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine

  • Molecular FormulaC18H9D4ClFN3
  • Average mass329.792 Da
  • Monoisotopic mass329.103302 Da
  • ChemSpider ID78057701

  • Non-standard isotope - Non-standard isotope

More details:

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

4H-Imidazo[1,5-a][1,4]benzodiazepine, 8-chloro-6-(6-fluorophenyl-2,3,4,5-d4)-1-methyl- [ACD/Index Name]
8-Chlor-6-[2-fluor(2H4)phenyl]-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin [German] [ACD/IUPAC Name]
8-Chloro-6-[2-fluoro(2H4)phenyl]-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine [ACD/IUPAC Name]
8-Chloro-6-[2-fluoro(2H4)phényl]-1-méthyl-4H-imidazo[1,5-a][1,4]benzodiazépine [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: 496.9±55.0 °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: 254.3±31.5 °C
Index of Refraction: 1.671
Molar Refractivity: 89.7±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.93
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 58.05
ACD/KOC (pH 5.5): 439.87
ACD/LogD (pH 7.4): 3.35
ACD/BCF (pH 7.4): 206.57
ACD/KOC (pH 7.4): 1565.35
Polar Surface Area: 30 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 46.2±7.0 dyne/cm
Molar Volume: 239.8±7.0 cm3

Click to predict properties on the Chemicalize site


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