ChemSpider 2D Image | Ethyl 5-{[1-(2-chlorophenyl)-2-oxocyclohexyl]amino}pentanoate | C19H26ClNO3

Ethyl 5-{[1-(2-chlorophenyl)-2-oxocyclohexyl]amino}pentanoate

  • Molecular FormulaC19H26ClNO3
  • Average mass351.868 Da
  • Monoisotopic mass351.160126 Da
  • ChemSpider ID30841507

More details:






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

5-{[1-(2-Chlorophényl)-2-oxocyclohexyl]amino}pentanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-{[1-(2-chlorophenyl)-2-oxocyclohexyl]amino}pentanoate [ACD/IUPAC Name]
Ethyl-5-{[1-(2-chlorphenyl)-2-oxocyclohexyl]amino}pentanoat [German] [ACD/IUPAC Name]
Pentanoic acid, 5-[[1-(2-chlorophenyl)-2-oxocyclohexyl]amino]-, ethyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 475.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 241.4±28.7 °C
Index of Refraction: 1.542
Molar Refractivity: 95.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 16.61
ACD/KOC (pH 5.5): 139.42
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 135.26
ACD/KOC (pH 7.4): 1135.63
Polar Surface Area: 55 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 45.5±5.0 dyne/cm
Molar Volume: 303.2±5.0 cm3

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