ChemSpider 2D Image | 6-{(E)-2-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]vinyl}-5,6-dihydro-2H-pyran-2-one | C25H20FNO2

6-{(E)-2-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]vinyl}-5,6-dihydro-2H-pyran-2-one

  • Molecular FormulaC25H20FNO2
  • Average mass385.430 Da
  • Monoisotopic mass385.147797 Da
  • ChemSpider ID76765615

  • Double-bond stereo - Double-bond stereo

More details:

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

2H-Pyran-2-one, 6-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]ethenyl]-5,6-dihydro- [ACD/Index Name]
6-{(E)-2-[2-Cyclopropyl-4-(4-fluorophényl)-3-quinoléinyl]vinyl}-5,6-dihydro-2H-pyran-2-one [French] [ACD/IUPAC Name]
6-{(E)-2-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]vinyl}-5,6-dihydro-2H-pyran-2-one [ACD/IUPAC Name]
6-{(E)-2-[2-Cyclopropyl-4-(4-fluorphenyl)-3-chinolinyl]vinyl}-5,6-dihydro-2H-pyran-2-on [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 590.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 310.6±30.1 °C
Index of Refraction: 1.716
Molar Refractivity: 114.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 5.10
ACD/BCF (pH 5.5): 4345.08
ACD/KOC (pH 5.5): 13637.53
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 4742.13
ACD/KOC (pH 7.4): 14883.70
Polar Surface Area: 39 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 63.7±3.0 dyne/cm
Molar Volume: 290.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement