ChemSpider 2D Image | 1-(3-Bromo-4-methylphenyl)-3-(2-hydroxy-3-methoxypropyl)urea | C12H17BrN2O3

1-(3-Bromo-4-methylphenyl)-3-(2-hydroxy-3-methoxypropyl)urea

  • Molecular FormulaC12H17BrN2O3
  • Average mass317.179 Da
  • Monoisotopic mass316.042236 Da
  • ChemSpider ID30475734

More details:

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

1-(3-Brom-4-methylphenyl)-3-(2-hydroxy-3-methoxypropyl)harnstoff [German] [ACD/IUPAC Name]
1-(3-Bromo-4-methylphenyl)-3-(2-hydroxy-3-methoxypropyl)urea [ACD/IUPAC Name]
1-(3-Bromo-4-méthylphényl)-3-(2-hydroxy-3-méthoxypropyl)urée [French] [ACD/IUPAC Name]
Urea, N-(3-bromo-4-methylphenyl)-N'-(2-hydroxy-3-methoxypropyl)- [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: 433.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.7±3.0 kJ/mol
Flash Point: 215.9±28.7 °C
Index of Refraction: 1.593
Molar Refractivity: 73.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 48.16
ACD/KOC (pH 5.5): 557.30
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 48.16
ACD/KOC (pH 7.4): 557.26
Polar Surface Area: 71 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 50.6±3.0 dyne/cm
Molar Volume: 217.6±3.0 cm3

Click to predict properties on the Chemicalize site


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