ChemSpider 2D Image | 5-(2-Fluorophenyl)-7-nitro(6,8,9-~2~H_3_)-1,3-dihydro-2H-1,4-benzodiazepin-2-one | C15H7D3FN3O3

5-(2-Fluorophenyl)-7-nitro(6,8,9-2H3)-1,3-dihydro-2H-1,4-benzodiazepin-2-one

  • Molecular FormulaC15H7D3FN3O3
  • Average mass302.275 Da
  • Monoisotopic mass302.089447 Da
  • ChemSpider ID48062464

  • 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-6,8,9-d3, 5-(2-fluorophenyl)-1,3-dihydro-7-nitro- [ACD/Index Name]
5-(2-Fluorophenyl)-7-nitro(6,8,9-2H3)-1,3-dihydro-2H-1,4-benzodiazepin-2-one [ACD/IUPAC Name]
5-(2-Fluorophényl)-7-nitro(6,8,9-2H3)-1,3-dihydro-2H-1,4-benzodiazépin-2-one [French] [ACD/IUPAC Name]
5-(2-Fluorphenyl)-7-nitro(6,8,9-2H3)-1,3-dihydro-2H-1,4-benzodiazepin-2-on [German] [ACD/IUPAC Name]
1216995-54-8 [RN]
6,8,9-trideuterio-5-(2-fluorophenyl)-7-nitro-1,3-dihydro-1,4-benzodiazepin-2-one

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

Density: 1.5±0.1 g/cm3
Boiling Point: 497.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 254.8±28.7 °C
Index of Refraction: 1.676
Molar Refractivity: 76.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.04
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 23.25
ACD/KOC (pH 5.5): 330.94
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 23.25
ACD/KOC (pH 7.4): 330.94
Polar Surface Area: 87 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 57.3±7.0 dyne/cm
Molar Volume: 203.5±7.0 cm3

Click to predict properties on the Chemicalize site


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