ChemSpider 2D Image | (2E,6E)-2-(2,3-Dichlorobenzylidene)-6-(4-hydroxy-3-methoxybenzylidene)cyclohexanone | C21H18Cl2O3

(2E,6E)-2-(2,3-Dichlorobenzylidene)-6-(4-hydroxy-3-methoxybenzylidene)cyclohexanone

  • Molecular FormulaC21H18Cl2O3
  • Average mass389.272 Da
  • Monoisotopic mass388.063293 Da
  • ChemSpider ID35033013

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,6E)-2-(2,3-Dichlorbenzyliden)-6-(4-hydroxy-3-methoxybenzyliden)cyclohexanon [German] [ACD/IUPAC Name]
(2E,6E)-2-(2,3-Dichlorobenzylidene)-6-(4-hydroxy-3-methoxybenzylidene)cyclohexanone [ACD/IUPAC Name]
(2E,6E)-2-(2,3-Dichlorobenzylidène)-6-(4-hydroxy-3-méthoxybenzylidène)cyclohexanone [French] [ACD/IUPAC Name]
Cyclohexanone, 2-[(2,3-dichlorophenyl)methylene]-6-[(4-hydroxy-3-methoxyphenyl)methylene]-, (2E,6E)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 589.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.2±3.0 kJ/mol
Flash Point: 310.0±30.1 °C
Index of Refraction: 1.678
Molar Refractivity: 107.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.10
ACD/LogD (pH 5.5): 5.38
ACD/BCF (pH 5.5): 7224.12
ACD/KOC (pH 5.5): 20123.22
ACD/LogD (pH 7.4): 5.38
ACD/BCF (pH 7.4): 7170.95
ACD/KOC (pH 7.4): 19975.10
Polar Surface Area: 47 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 59.0±3.0 dyne/cm
Molar Volume: 284.9±3.0 cm3

Click to predict properties on the Chemicalize site


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