ChemSpider 2D Image | 1-[(2E)-3-(4-Chlorophenyl)-2-propenoyl]-N-cyclododecyl-4-piperidinecarboxamide | C27H39ClN2O2

1-[(2E)-3-(4-Chlorophenyl)-2-propenoyl]-N-cyclododecyl-4-piperidinecarboxamide

  • Molecular FormulaC27H39ClN2O2
  • Average mass459.064 Da
  • Monoisotopic mass458.270020 Da
  • ChemSpider ID66768310

  • Double-bond stereo - Double-bond stereo

More details:

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

1-[(2E)-3-(4-Chlorophenyl)-2-propenoyl]-N-cyclododecyl-4-piperidinecarboxamide [ACD/IUPAC Name]
1-[(2E)-3-(4-Chlorophényl)-2-propenoyl]-N-cyclododécyl-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1-[(2E)-3-(4-Chlorphenyl)-2-propenoyl]-N-cyclododecyl-4-piperidincarboxamid [German] [ACD/IUPAC Name]
4-Piperidinecarboxamide, 1-[(2E)-3-(4-chlorophenyl)-1-oxo-2-propen-1-yl]-N-cyclododecyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 682.6±54.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.1±3.0 kJ/mol
Flash Point: 366.6±31.2 °C
Index of Refraction: 1.562
Molar Refractivity: 132.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.93
ACD/LogD (pH 5.5): 5.89
ACD/BCF (pH 5.5): 17616.89
ACD/KOC (pH 5.5): 38091.05
ACD/LogD (pH 7.4): 5.89
ACD/BCF (pH 7.4): 17616.91
ACD/KOC (pH 7.4): 38091.09
Polar Surface Area: 49 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 47.6±5.0 dyne/cm
Molar Volume: 408.1±5.0 cm3

Click to predict properties on the Chemicalize site


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