ChemSpider 2D Image | (2E)-3-[4-(Trifluoromethyl)phenyl]acrylonitrile | C10H6F3N

(2E)-3-[4-(Trifluoromethyl)phenyl]acrylonitrile

  • Molecular FormulaC10H6F3N
  • Average mass197.156 Da
  • Monoisotopic mass197.045227 Da
  • ChemSpider ID30995556

More details:

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

(2E)-3-[4-(Trifluormethyl)phenyl]acrylonitril [German] [ACD/IUPAC Name]
(2E)-3-[4-(Trifluoromethyl)phenyl]acrylonitrile [ACD/IUPAC Name]
(2E)-3-[4-(Trifluorométhyl)phényl]acrylonitrile [French] [ACD/IUPAC Name]
2-Propenenitrile, 3-[4-(trifluoromethyl)phenyl]-, (2E)- [ACD/Index Name]
24654-53-3 [RN]
3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile

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

Density: 1.3±0.1 g/cm3
Boiling Point: 249.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.7±3.0 kJ/mol
Flash Point: 104.7±25.9 °C
Index of Refraction: 1.510
Molar Refractivity: 47.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.28
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 242.28
ACD/KOC (pH 5.5): 1771.32
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 242.28
ACD/KOC (pH 7.4): 1771.32
Polar Surface Area: 24 Å2
Polarizability: 18.6±0.5 10-24cm3
Surface Tension: 32.6±3.0 dyne/cm
Molar Volume: 157.3±3.0 cm3

Click to predict properties on the Chemicalize site


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