ChemSpider 2D Image | 1-{2-[(1-Methyl-4-nitro-1H-imidazol-5-yl)amino]ethyl}urea | C7H12N6O3

1-{2-[(1-Methyl-4-nitro-1H-imidazol-5-yl)amino]ethyl}urea

  • Molecular FormulaC7H12N6O3
  • Average mass228.209 Da
  • Monoisotopic mass228.097092 Da
  • ChemSpider ID41024861

More details:

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

1-{2-[(1-Methyl-4-nitro-1H-imidazol-5-yl)amino]ethyl}harnstoff [German] [ACD/IUPAC Name]
1-{2-[(1-Methyl-4-nitro-1H-imidazol-5-yl)amino]ethyl}urea [ACD/IUPAC Name]
1-{2-[(1-Méthyl-4-nitro-1H-imidazol-5-yl)amino]éthyl}urée [French] [ACD/IUPAC Name]
Urea, N-[2-[(1-methyl-4-nitro-1H-imidazol-5-yl)amino]ethyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 554.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.5±3.0 kJ/mol
Flash Point: 289.1±30.1 °C
Index of Refraction: 1.690
Molar Refractivity: 53.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.14
ACD/LogD (pH 5.5): -0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.29
ACD/LogD (pH 7.4): -0.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.30
Polar Surface Area: 131 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 75.8±7.0 dyne/cm
Molar Volume: 140.3±7.0 cm3

Click to predict properties on the Chemicalize site


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