ChemSpider 2D Image | Ethyl 8-(3-chlorophenyl)-8-oxooctanoate | C16H21ClO3

Ethyl 8-(3-chlorophenyl)-8-oxooctanoate

  • Molecular FormulaC16H21ClO3
  • Average mass296.789 Da
  • Monoisotopic mass296.117920 Da
  • ChemSpider ID21402116

More details:

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

8-(3-Chlorophényl)-8-oxooctanoate d'éthyle [French] [ACD/IUPAC Name]
Benzeneoctanoic acid, 3-chloro-η-oxo-, ethyl ester [ACD/Index Name]
Ethyl 8-(3-chlorophenyl)-8-oxooctanoate [ACD/IUPAC Name]
Ethyl-8-(3-chlorphenyl)-8-oxooctanoat [German] [ACD/IUPAC Name]
898752-20-0 [RN]
97%
ETHYL8-(3-CHLOROPHENYL)-8-OXOOCTANOATE
MFCD01320240 [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: 404.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.6±3.0 kJ/mol
Flash Point: 148.0±23.6 °C
Index of Refraction: 1.508
Molar Refractivity: 80.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 4.23
ACD/BCF (pH 5.5): 963.69
ACD/KOC (pH 5.5): 4758.86
ACD/LogD (pH 7.4): 4.23
ACD/BCF (pH 7.4): 963.69
ACD/KOC (pH 7.4): 4758.86
Polar Surface Area: 43 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 39.1±3.0 dyne/cm
Molar Volume: 268.5±3.0 cm3

Click to predict properties on the Chemicalize site


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