ChemSpider 2D Image | 1-(2-Bromo-4-methyl-5-nitrophenyl)-3-(2-ethoxyethyl)urea | C12H16BrN3O4

1-(2-Bromo-4-methyl-5-nitrophenyl)-3-(2-ethoxyethyl)urea

  • Molecular FormulaC12H16BrN3O4
  • Average mass346.177 Da
  • Monoisotopic mass345.032410 Da
  • ChemSpider ID30429926

More details:

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

1-(2-Brom-4-methyl-5-nitrophenyl)-3-(2-ethoxyethyl)harnstoff [German] [ACD/IUPAC Name]
1-(2-Bromo-4-methyl-5-nitrophenyl)-3-(2-ethoxyethyl)urea [ACD/IUPAC Name]
1-(2-Bromo-4-méthyl-5-nitrophényl)-3-(2-éthoxyéthyl)urée [French] [ACD/IUPAC Name]
Urea, N-(2-bromo-4-methyl-5-nitrophenyl)-N'-(2-ethoxyethyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 409.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.2±3.0 kJ/mol
Flash Point: 201.7±28.7 °C
Index of Refraction: 1.596
Molar Refractivity: 78.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 117.99
ACD/KOC (pH 5.5): 1058.34
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 117.97
ACD/KOC (pH 7.4): 1058.16
Polar Surface Area: 96 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 231.5±3.0 cm3

Click to predict properties on the Chemicalize site


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