ChemSpider 2D Image | ethanone, 1-[3-ethenyl-4-[(3R)-3-hydroxy-3-(4-quinolinyl)propyl]-1-piperidinyl]- | C21H26N2O2

ethanone, 1-[3-ethenyl-4-[(3R)-3-hydroxy-3-(4-quinolinyl)propyl]-1-piperidinyl]-

  • Molecular FormulaC21H26N2O2
  • Average mass338.443 Da
  • Monoisotopic mass338.199432 Da
  • ChemSpider ID21431217

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

ethanone, 1-[3-ethenyl-4-[(3R)-3-hydroxy-3-(4-quinolinyl)propyl]-1-piperidinyl]-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 544.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 283.1±28.7 °C
Index of Refraction: 1.625
Molar Refractivity: 102.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.37
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 59.71
ACD/KOC (pH 5.5): 592.10
ACD/LogD (pH 7.4): 2.83
ACD/BCF (pH 7.4): 82.52
ACD/KOC (pH 7.4): 818.22
Polar Surface Area: 53 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 290.0±3.0 cm3

Click to predict properties on the Chemicalize site


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