ChemSpider 2D Image | 8-Chloro-6-(2-fluorophenyl)-1-(~2~H_3_)methyl(3,4-~2~H_2_)-4H-imidazo[1,5-a][1,4]benzodiazepin-4-ol | C18H8D5ClFN3O

8-Chloro-6-(2-fluorophenyl)-1-(2H3)methyl(3,4-2H2)-4H-imidazo[1,5-a][1,4]benzodiazepin-4-ol

  • Molecular FormulaC18H8D5ClFN3O
  • Average mass346.797 Da
  • Monoisotopic mass346.104492 Da
  • ChemSpider ID78057709

  • 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]benzodiazepin-3,4-d2-4-ol, 8-chloro-6-(2-fluorophenyl)-1-(methyl-d3)- [ACD/Index Name]
8-Chlor-6-(2-fluorphenyl)-1-(2H3)methyl(3,4-2H2)-4H-imidazo[1,5-a][1,4]benzodiazepin-4-ol [German] [ACD/IUPAC Name]
8-Chloro-6-(2-fluorophenyl)-1-(2H3)methyl(3,4-2H2)-4H-imidazo[1,5-a][1,4]benzodiazepin-4-ol [ACD/IUPAC Name]
8-Chloro-6-(2-fluorophényl)-1-(2H3)méthyl(3,4-2H2)-4H-imidazo[1,5-a][1,4]benzodiazépin-4-ol [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: 550.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 286.8±32.9 °C
Index of Refraction: 1.689
Molar Refractivity: 90.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 40.26
ACD/KOC (pH 5.5): 417.81
ACD/LogD (pH 7.4): 2.73
ACD/BCF (pH 7.4): 69.97
ACD/KOC (pH 7.4): 726.15
Polar Surface Area: 50 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 50.1±7.0 dyne/cm
Molar Volume: 237.1±7.0 cm3

Click to predict properties on the Chemicalize site


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