ChemSpider 2D Image | 4-Ethoxyphenyl cis-4-butylcyclohexanecarboxylate | C19H28O3

4-Ethoxyphenyl cis-4-butylcyclohexanecarboxylate

  • Molecular FormulaC19H28O3
  • Average mass304.424 Da
  • Monoisotopic mass304.203857 Da
  • ChemSpider ID113606911

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

4-Ethoxyphenyl cis-4-butylcyclohexanecarboxylate [ACD/IUPAC Name]
4-Ethoxyphenyl-cis-4-butylcyclohexancarboxylat [German] [ACD/IUPAC Name]
cis-4-Butylcyclohexanecarboxylate de 4-éthoxyphényle [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 4-butyl-, 4-ethoxyphenyl ester, cis- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 409.7±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.2±3.0 kJ/mol
Flash Point: 173.7±18.6 °C
Index of Refraction: 1.500
Molar Refractivity: 88.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.16
ACD/LogD (pH 5.5): 5.61
ACD/BCF (pH 5.5): 10837.36
ACD/KOC (pH 5.5): 26902.19
ACD/LogD (pH 7.4): 5.61
ACD/BCF (pH 7.4): 10837.36
ACD/KOC (pH 7.4): 26902.19
Polar Surface Area: 36 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 35.7±3.0 dyne/cm
Molar Volume: 300.7±3.0 cm3

Click to predict properties on the Chemicalize site


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