ChemSpider 2D Image | 1-[3-(1,1-Difluoroethyl)phenyl]-3-(2,2,3,3-tetrafluoropropyl)urea | C12H12F6N2O

1-[3-(1,1-Difluoroethyl)phenyl]-3-(2,2,3,3-tetrafluoropropyl)urea

  • Molecular FormulaC12H12F6N2O
  • Average mass314.227 Da
  • Monoisotopic mass314.085388 Da
  • ChemSpider ID60550126

More details:

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

1-[3-(1,1-Difluorethyl)phenyl]-3-(2,2,3,3-tetrafluorpropyl)harnstoff [German] [ACD/IUPAC Name]
1-[3-(1,1-Difluoroethyl)phenyl]-3-(2,2,3,3-tetrafluoropropyl)urea [ACD/IUPAC Name]
1-[3-(1,1-Difluoroéthyl)phényl]-3-(2,2,3,3-tétrafluoropropyl)urée [French] [ACD/IUPAC Name]
Urea, N-[3-(1,1-difluoroethyl)phenyl]-N'-(2,2,3,3-tetrafluoropropyl)- [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: 310.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.1±3.0 kJ/mol
Flash Point: 141.4±27.9 °C
Index of Refraction: 1.461
Molar Refractivity: 63.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 173.95
ACD/KOC (pH 5.5): 1397.37
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 173.92
ACD/KOC (pH 7.4): 1397.11
Polar Surface Area: 41 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 29.0±3.0 dyne/cm
Molar Volume: 231.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement