ChemSpider 2D Image | 7-Chloro-5-(2-chloro-6-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one | C15H9Cl2FN2O

7-Chloro-5-(2-chloro-6-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one

  • Molecular FormulaC15H9Cl2FN2O
  • Average mass323.149 Da
  • Monoisotopic mass322.007599 Da
  • ChemSpider ID23222135

More details:






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

2H-1,4-Benzodiazepin-2-one, 7-chloro-5-(2-chloro-6-fluorophenyl)-1,3-dihydro- [ACD/Index Name]
7-Chlor-5-(2-chlor-6-fluorphenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-on [German] [ACD/IUPAC Name]
7-Chloro-5-(2-chloro-6-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one [ACD/IUPAC Name]
7-Chloro-5-(2-chloro-6-fluorophényl)-1,3-dihydro-2H-1,4-benzodiazépin-2-one [French] [ACD/IUPAC Name]
10.1021/jm960536o
7-Chloro-5-(2-chloro-6-fluoro-phenyl)-1,3-dihydro-benzo[e][1,4]diazepin-2-one
Ro-07-5193

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 477.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 242.6±28.7 °C
Index of Refraction: 1.660
Molar Refractivity: 80.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 173.46
ACD/KOC (pH 5.5): 1394.50
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 173.46
ACD/KOC (pH 7.4): 1394.46
Polar Surface Area: 41 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 48.5±7.0 dyne/cm
Molar Volume: 216.8±7.0 cm3

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