ChemSpider 2D Image | 1-[4-Ethoxy-2-(trifluoromethyl)phenyl]-3-[3-(trifluoromethyl)benzyl]urea | C18H16F6N2O2

1-[4-Ethoxy-2-(trifluoromethyl)phenyl]-3-[3-(trifluoromethyl)benzyl]urea

  • Molecular FormulaC18H16F6N2O2
  • Average mass406.322 Da
  • Monoisotopic mass406.111603 Da
  • ChemSpider ID31920935

More details:

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

1-[4-Ethoxy-2-(trifluormethyl)phenyl]-3-[3-(trifluormethyl)benzyl]harnstoff [German] [ACD/IUPAC Name]
1-[4-Ethoxy-2-(trifluoromethyl)phenyl]-3-[3-(trifluoromethyl)benzyl]urea [ACD/IUPAC Name]
1-[4-Éthoxy-2-(trifluorométhyl)phényl]-3-[3-(trifluorométhyl)benzyl]urée [French] [ACD/IUPAC Name]
Urea, N-[4-ethoxy-2-(trifluoromethyl)phenyl]-N'-[[3-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 419.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 207.6±28.7 °C
Index of Refraction: 1.512
Molar Refractivity: 89.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 5.29
ACD/BCF (pH 5.5): 6125.55
ACD/KOC (pH 5.5): 17882.57
ACD/LogD (pH 7.4): 5.29
ACD/BCF (pH 7.4): 6124.94
ACD/KOC (pH 7.4): 17880.80
Polar Surface Area: 50 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 33.7±3.0 dyne/cm
Molar Volume: 299.6±3.0 cm3

Click to predict properties on the Chemicalize site


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