ChemSpider 2D Image | 2-{[4-(2-Methyl-2-propanyl)cyclohexyl]oxy}-2-oxoethyl (2E)-3-(2,4-dichlorophenyl)acrylate | C21H26Cl2O4

2-{[4-(2-Methyl-2-propanyl)cyclohexyl]oxy}-2-oxoethyl (2E)-3-(2,4-dichlorophenyl)acrylate

  • Molecular FormulaC21H26Cl2O4
  • Average mass413.335 Da
  • Monoisotopic mass412.120819 Da
  • ChemSpider ID67201833

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(2,4-Dichlorophényl)acrylate de 2-{[4-(2-méthyl-2-propanyl)cyclohexyl]oxy}-2-oxoéthyle [French] [ACD/IUPAC Name]
2-{[4-(2-Methyl-2-propanyl)cyclohexyl]oxy}-2-oxoethyl (2E)-3-(2,4-dichlorophenyl)acrylate [ACD/IUPAC Name]
2-{[4-(2-Methyl-2-propanyl)cyclohexyl]oxy}-2-oxoethyl-(2E)-3-(2,4-dichlorphenyl)acrylat [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-(2,4-dichlorophenyl)-, 2-[[4-(1,1-dimethylethyl)cyclohexyl]oxy]-2-oxoethyl ester, (2E)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 505.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 168.4±27.7 °C
Index of Refraction: 1.545
Molar Refractivity: 107.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.97
ACD/LogD (pH 5.5): 6.49
ACD/BCF (pH 5.5): 50646.71
ACD/KOC (pH 5.5): 81114.70
ACD/LogD (pH 7.4): 6.49
ACD/BCF (pH 7.4): 50646.71
ACD/KOC (pH 7.4): 81114.70
Polar Surface Area: 53 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 45.2±5.0 dyne/cm
Molar Volume: 339.5±5.0 cm3

Click to predict properties on the Chemicalize site


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