ChemSpider 2D Image | 2,3-Diphenyl-4-propyl-1(2H)-isoquinolinone | C24H21NO

2,3-Diphenyl-4-propyl-1(2H)-isoquinolinone

  • Molecular FormulaC24H21NO
  • Average mass339.430 Da
  • Monoisotopic mass339.162323 Da
  • ChemSpider ID30659296

More details:

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

1(2H)-Isoquinolinone, 2,3-diphenyl-4-propyl- [ACD/Index Name]
2,3-Diphenyl-4-propyl-1(2H)-isochinolinon [German] [ACD/IUPAC Name]
2,3-Diphényl-4-propyl-1(2H)-isoquinoléinone [French] [ACD/IUPAC Name]
2,3-Diphenyl-4-propyl-1(2H)-isoquinolinone [ACD/IUPAC 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: 515.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.8±3.0 kJ/mol
Flash Point: 239.6±21.3 °C
Index of Refraction: 1.626
Molar Refractivity: 104.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.15
ACD/LogD (pH 5.5): 5.08
ACD/BCF (pH 5.5): 4301.40
ACD/KOC (pH 5.5): 13884.54
ACD/LogD (pH 7.4): 5.08
ACD/BCF (pH 7.4): 4301.40
ACD/KOC (pH 7.4): 13884.54
Polar Surface Area: 20 Å2
Polarizability: 41.5±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 295.5±3.0 cm3

Click to predict properties on the Chemicalize site


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