ChemSpider 2D Image | 4-{3-[2-(Trifluoromethyl)phenyl]acryloyl}benzonitrile | C17H10F3NO

4-{3-[2-(Trifluoromethyl)phenyl]acryloyl}benzonitrile

  • Molecular FormulaC17H10F3NO
  • Average mass301.263 Da
  • Monoisotopic mass301.071442 Da
  • ChemSpider ID35428716

More details:

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

4-{3-[2-(Trifluormethyl)phenyl]acryloyl}benzonitril [German] [ACD/IUPAC Name]
4-{3-[2-(Trifluoromethyl)phenyl]acryloyl}benzonitrile [ACD/IUPAC Name]
4-{3-[2-(Trifluorométhyl)phényl]acryloyl}benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-[1-oxo-3-[2-(trifluoromethyl)phenyl]-2-propen-1-yl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 421.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.5±3.0 kJ/mol
Flash Point: 208.4±28.7 °C
Index of Refraction: 1.562
Molar Refractivity: 74.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 698.95
ACD/KOC (pH 5.5): 3781.41
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 698.95
ACD/KOC (pH 7.4): 3781.41
Polar Surface Area: 41 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 45.5±5.0 dyne/cm
Molar Volume: 231.0±5.0 cm3

Click to predict properties on the Chemicalize site


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