ChemSpider 2D Image | Ethyl 3-(cyclohexylcarbonyl)benzoate | C16H20O3

Ethyl 3-(cyclohexylcarbonyl)benzoate

  • Molecular FormulaC16H20O3
  • Average mass260.328 Da
  • Monoisotopic mass260.141235 Da
  • ChemSpider ID21398903

More details:

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

3-(Cyclohexylcarbonyl)benzoate d'éthyle [French] [ACD/IUPAC Name]
3-Carboethoxyphenyl cyclohexyl ketone
898792-20-6 [RN]
Benzoic acid, 3-(cyclohexylcarbonyl)-, ethyl ester [ACD/Index Name]
Ethyl 3-(cyclohexylcarbonyl)benzoate [ACD/IUPAC Name]
Ethyl-3-(cyclohexylcarbonyl)benzoat [German] [ACD/IUPAC Name]
ethyl 3-(cyclohexanecarbonyl)benzoate
ETHYL 3-CYCLOHEXANECARBONYLBENZOATE
MFCD03841346 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 395.1±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.5±3.0 kJ/mol
Flash Point: 173.9±23.2 °C
Index of Refraction: 1.532
Molar Refractivity: 73.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 4.33
ACD/BCF (pH 5.5): 1149.86
ACD/KOC (pH 5.5): 5400.19
ACD/LogD (pH 7.4): 4.33
ACD/BCF (pH 7.4): 1149.86
ACD/KOC (pH 7.4): 5400.19
Polar Surface Area: 43 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 41.7±3.0 dyne/cm
Molar Volume: 237.9±3.0 cm3

Click to predict properties on the Chemicalize site


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