ChemSpider 2D Image | (4E)-7-Fluoro-4-(2-fluorobenzylidene)-3,4-dihydro-1-benzoxepin-5(2H)-one | C17H12F2O2

(4E)-7-Fluoro-4-(2-fluorobenzylidene)-3,4-dihydro-1-benzoxepin-5(2H)-one

  • Molecular FormulaC17H12F2O2
  • Average mass286.273 Da
  • Monoisotopic mass286.080536 Da
  • ChemSpider ID22877904

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-7-Fluor-4-(2-fluorbenzyliden)-3,4-dihydro-1-benzoxepin-5(2H)-on [German] [ACD/IUPAC Name]
(4E)-7-Fluoro-4-(2-fluorobenzylidene)-3,4-dihydro-1-benzoxepin-5(2H)-one [ACD/IUPAC Name]
(4E)-7-Fluoro-4-(2-fluorobenzylidène)-3,4-dihydro-1-benzoxépin-5(2H)-one [French] [ACD/IUPAC Name]
1-Benzoxepin-5(2H)-one, 7-fluoro-4-[(2-fluorophenyl)methylene]-3,4-dihydro-, (4E)- [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: 432.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.8±3.0 kJ/mol
Flash Point: 207.8±23.6 °C
Index of Refraction: 1.609
Molar Refractivity: 75.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.76
ACD/LogD (pH 5.5): 4.17
ACD/BCF (pH 5.5): 869.23
ACD/KOC (pH 5.5): 4420.11
ACD/LogD (pH 7.4): 4.17
ACD/BCF (pH 7.4): 869.23
ACD/KOC (pH 7.4): 4420.11
Polar Surface Area: 26 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 217.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement