ChemSpider 2D Image | 1-(6-Methoxy-4-quinolinyl)-3-[(3S,4S)-3-vinyl-4-piperidinyl]-1-propanone | C20H24N2O2

1-(6-Methoxy-4-quinolinyl)-3-[(3S,4S)-3-vinyl-4-piperidinyl]-1-propanone

  • Molecular FormulaC20H24N2O2
  • Average mass324.417 Da
  • Monoisotopic mass324.183777 Da
  • ChemSpider ID78315637

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-(6-Methoxy-4-chinolinyl)-3-[(3S,4S)-3-vinyl-4-piperidinyl]-1-propanon [German] [ACD/IUPAC Name]
1-(6-Méthoxy-4-quinoléinyl)-3-[(3S,4S)-3-vinyl-4-pipéridinyl]-1-propanone [French] [ACD/IUPAC Name]
1-(6-Methoxy-4-quinolinyl)-3-[(3S,4S)-3-vinyl-4-piperidinyl]-1-propanone [ACD/IUPAC Name]
1-Propanone, 3-[(3S,4S)-3-ethenyl-4-piperidinyl]-1-(6-methoxy-4-quinolinyl)- [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: 493.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.0±3.0 kJ/mol
Flash Point: 252.0±27.3 °C
Index of Refraction: 1.601
Molar Refractivity: 98.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.21
ACD/LogD (pH 5.5): 0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.23
ACD/LogD (pH 7.4): 0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.98
Polar Surface Area: 51 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 288.2±3.0 cm3

Click to predict properties on the Chemicalize site


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