ChemSpider 2D Image | 2-{4-[(4-Butylcyclohexyl)carbonyl]-1-piperazinyl}ethyl 3-cyclohexylpropanoate | C26H46N2O3

2-{4-[(4-Butylcyclohexyl)carbonyl]-1-piperazinyl}ethyl 3-cyclohexylpropanoate

  • Molecular FormulaC26H46N2O3
  • Average mass434.655 Da
  • Monoisotopic mass434.350830 Da
  • ChemSpider ID59395800

More details:






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

2-{4-[(4-Butylcyclohexyl)carbonyl]-1-piperazinyl}ethyl 3-cyclohexylpropanoate [ACD/IUPAC Name]
2-{4-[(4-Butylcyclohexyl)carbonyl]-1-piperazinyl}ethyl-3-cyclohexylpropanoat [German] [ACD/IUPAC Name]
3-Cyclohexylpropanoate de 2-{4-[(4-butylcyclohexyl)carbonyl]-1-pipérazinyl}éthyle [French] [ACD/IUPAC Name]
Cyclohexanepropanoic acid, 2-[4-[(4-butylcyclohexyl)carbonyl]-1-piperazinyl]ethyl ester [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 568.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 297.5±28.7 °C
Index of Refraction: 1.499
Molar Refractivity: 125.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 7.15
ACD/LogD (pH 5.5): 6.04
ACD/BCF (pH 5.5): 20210.07
ACD/KOC (pH 5.5): 36489.64
ACD/LogD (pH 7.4): 6.25
ACD/BCF (pH 7.4): 32952.91
ACD/KOC (pH 7.4): 59497.07
Polar Surface Area: 50 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 426.0±3.0 cm3

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