ChemSpider 2D Image | (3E)-3-(2,6-Dichlorobenzylidene)-5-(4-isobutylphenyl)-2(3H)-furanone | C21H18Cl2O2

(3E)-3-(2,6-Dichlorobenzylidene)-5-(4-isobutylphenyl)-2(3H)-furanone

  • Molecular FormulaC21H18Cl2O2
  • Average mass373.272 Da
  • Monoisotopic mass372.068390 Da
  • ChemSpider ID61734116

More details:

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

(3E)-3-(2,6-Dichlorbenzyliden)-5-(4-isobutylphenyl)-2(3H)-furanon [German] [ACD/IUPAC Name]
(3E)-3-(2,6-Dichlorobenzylidene)-5-(4-isobutylphenyl)-2(3H)-furanone [ACD/IUPAC Name]
(3E)-3-(2,6-Dichlorobenzylidène)-5-(4-isobutylphényl)-2(3H)-furanone [French] [ACD/IUPAC Name]
2(3H)-Furanone, 3-[(2,6-dichlorophenyl)methylene]-5-[4-(2-methylpropyl)phenyl]-, (3E)- [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: 547.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 203.8±29.1 °C
Index of Refraction: 1.633
Molar Refractivity: 103.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.79
ACD/LogD (pH 5.5): 6.17
ACD/BCF (pH 5.5): 28973.84
ACD/KOC (pH 5.5): 54386.16
ACD/LogD (pH 7.4): 6.17
ACD/BCF (pH 7.4): 28973.84
ACD/KOC (pH 7.4): 54386.16
Polar Surface Area: 26 Å2
Polarizability: 41.0±0.5 10-24cm3
Surface Tension: 50.6±3.0 dyne/cm
Molar Volume: 289.6±3.0 cm3

Click to predict properties on the Chemicalize site


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