ChemSpider 2D Image | 2-Methyl-4-nitro-1-phenyl-1H-imidazole-5-carbonitrile | C11H8N4O2

2-Methyl-4-nitro-1-phenyl-1H-imidazole-5-carbonitrile

  • Molecular FormulaC11H8N4O2
  • Average mass228.207 Da
  • Monoisotopic mass228.064728 Da
  • ChemSpider ID21134277

More details:

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

1H-Imidazole-5-carbonitrile, 2-methyl-4-nitro-1-phenyl- [ACD/Index Name]
2-Methyl-4-nitro-1-phenyl-1H-imidazol-5-carbonitril [German] [ACD/IUPAC Name]
2-Methyl-4-nitro-1-phenyl-1H-imidazole-5-carbonitrile [ACD/IUPAC Name]
2-Méthyl-4-nitro-1-phényl-1H-imidazole-5-carbonitrile [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 485.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.1±3.0 kJ/mol
Flash Point: 247.6±31.5 °C
Index of Refraction: 1.660
Molar Refractivity: 62.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.35
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 4.73
ACD/KOC (pH 5.5): 105.90
ACD/LogD (pH 7.4): 1.19
ACD/BCF (pH 7.4): 4.73
ACD/KOC (pH 7.4): 105.90
Polar Surface Area: 87 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 58.4±7.0 dyne/cm
Molar Volume: 169.5±7.0 cm3

Click to predict properties on the Chemicalize site


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