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ChemSpider 2D Image | Ethyl 6-(3-acetoxyphenyl)-6-oxohexanoate | C16H20O5

Ethyl 6-(3-acetoxyphenyl)-6-oxohexanoate

  • Molecular FormulaC16H20O5
  • Average mass292.327 Da
  • Monoisotopic mass292.131073 Da
  • ChemSpider ID21402391

More details:

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

6-(3-Acétoxyphényl)-6-oxohexanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenehexanoic acid, 3-(acetyloxy)-ε-oxo-, ethyl ester [ACD/Index Name]
Ethyl 6-(3-acetoxyphenyl)-6-oxohexanoate [ACD/IUPAC Name]
Ethyl-6-(3-acetoxyphenyl)-6-oxohexanoat [German] [ACD/IUPAC Name]
898758-81-1 [RN]
Ethyl 6-(3-acetoxyphenyl)-6-oxohexanote
ethyl 6-(3-acetyloxyphenyl)-6-oxohexanoate
MFCD07700174 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 417.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.1±3.0 kJ/mol
Flash Point: 183.3±24.6 °C
Index of Refraction: 1.503
Molar Refractivity: 77.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 53.22
ACD/KOC (pH 5.5): 598.58
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 53.22
ACD/KOC (pH 7.4): 598.58
Polar Surface Area: 70 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 40.2±3.0 dyne/cm
Molar Volume: 261.1±3.0 cm3

Click to predict properties on the Chemicalize site