ChemSpider 2D Image | Ethyl 4-{[1-(2-chlorophenyl)-2-oxocyclohexyl]amino}butanoate | C18H24ClNO3

Ethyl 4-{[1-(2-chlorophenyl)-2-oxocyclohexyl]amino}butanoate

  • Molecular FormulaC18H24ClNO3
  • Average mass337.841 Da
  • Monoisotopic mass337.144470 Da
  • ChemSpider ID30842620

More details:

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

4-{[1-(2-Chlorophényl)-2-oxocyclohexyl]amino}butanoate d'éthyle [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[1-(2-chlorophenyl)-2-oxocyclohexyl]amino]-, ethyl ester [ACD/Index Name]
Ethyl 4-{[1-(2-chlorophenyl)-2-oxocyclohexyl]amino}butanoate [ACD/IUPAC Name]
Ethyl-4-{[1-(2-chlorphenyl)-2-oxocyclohexyl]amino}butanoat [German] [ACD/IUPAC 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: 476.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.0±3.0 kJ/mol
Flash Point: 242.0±28.7 °C
Index of Refraction: 1.545
Molar Refractivity: 90.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.20
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 16.38
ACD/KOC (pH 5.5): 162.29
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 79.15
ACD/KOC (pH 7.4): 783.98
Polar Surface Area: 55 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 46.0±5.0 dyne/cm
Molar Volume: 287.0±5.0 cm3

Click to predict properties on the Chemicalize site


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