ChemSpider 2D Image | 1-Methyl-7-nitro-5-(2-nitrophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one | C16H12N4O5

1-Methyl-7-nitro-5-(2-nitrophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one

  • Molecular FormulaC16H12N4O5
  • Average mass340.290 Da
  • Monoisotopic mass340.080780 Da
  • ChemSpider ID24680683

More details:

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

1-Methyl-7-nitro-5-(2-nitrophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-on [German] [ACD/IUPAC Name]
1-Methyl-7-nitro-5-(2-nitrophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one [ACD/IUPAC Name]
1-Méthyl-7-nitro-5-(2-nitrophényl)-1,3-dihydro-2H-1,4-benzodiazépin-2-one [French] [ACD/IUPAC Name]
2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-1-methyl-7-nitro-5-(2-nitrophenyl)- [ACD/Index Name]
CHEMBL170808

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

Density: 1.5±0.1 g/cm3
Boiling Point: 614.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 325.3±31.5 °C
Index of Refraction: 1.698
Molar Refractivity: 87.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.91
ACD/LogD (pH 5.5): 1.95
ACD/BCF (pH 5.5): 17.86
ACD/KOC (pH 5.5): 273.98
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 17.86
ACD/KOC (pH 7.4): 273.98
Polar Surface Area: 124 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 67.2±7.0 dyne/cm
Molar Volume: 227.2±7.0 cm3

Click to predict properties on the Chemicalize site


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