ChemSpider 2D Image | 1-[3,5-Bis(trifluoromethyl)phenyl]-3-[(E)-2-cyclopropylvinyl]urea | C14H12F6N2O

1-[3,5-Bis(trifluoromethyl)phenyl]-3-[(E)-2-cyclopropylvinyl]urea

  • Molecular FormulaC14H12F6N2O
  • Average mass338.248 Da
  • Monoisotopic mass338.085388 Da
  • ChemSpider ID34633912

  • Double-bond stereo - Double-bond stereo

More details:

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

1-[3,5-Bis(trifluormethyl)phenyl]-3-[(E)-2-cyclopropylvinyl]harnstoff [German] [ACD/IUPAC Name]
1-[3,5-Bis(trifluoromethyl)phenyl]-3-[(E)-2-cyclopropylvinyl]urea [ACD/IUPAC Name]
1-[3,5-Bis(trifluorométhyl)phényl]-3-[(E)-2-cyclopropylvinyl]urée [French] [ACD/IUPAC Name]
Urea, N-[3,5-bis(trifluoromethyl)phenyl]-N'-[(E)-2-cyclopropylethenyl]- [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: 300.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.1±3.0 kJ/mol
Flash Point: 135.6±27.9 °C
Index of Refraction: 1.553
Molar Refractivity: 72.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 1082.82
ACD/KOC (pH 5.5): 5172.91
ACD/LogD (pH 7.4): 4.30
ACD/BCF (pH 7.4): 1082.49
ACD/KOC (pH 7.4): 5171.35
Polar Surface Area: 41 Å2
Polarizability: 28.7±0.5 10-24cm3
Surface Tension: 36.3±3.0 dyne/cm
Molar Volume: 225.9±3.0 cm3

Click to predict properties on the Chemicalize site


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