ChemSpider 2D Image | 3-[4-(2-Methyl-2-propanyl)phenyl]-2-phenyl-4H-chromen-4-one | C25H22O2

3-[4-(2-Methyl-2-propanyl)phenyl]-2-phenyl-4H-chromen-4-one

  • Molecular FormulaC25H22O2
  • Average mass354.441 Da
  • Monoisotopic mass354.161987 Da
  • ChemSpider ID22789527

More details:

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

3-[4-(2-Methyl-2-propanyl)phenyl]-2-phenyl-4H-chromen-4-on [German] [ACD/IUPAC Name]
3-[4-(2-Methyl-2-propanyl)phenyl]-2-phenyl-4H-chromen-4-one [ACD/IUPAC Name]
3-[4-(2-Méthyl-2-propanyl)phényl]-2-phényl-4H-chromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-[4-(1,1-dimethylethyl)phenyl]-2-phenyl- [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: 490.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.7±3.0 kJ/mol
Flash Point: 199.6±22.3 °C
Index of Refraction: 1.611
Molar Refractivity: 107.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 6.05
ACD/BCF (pH 5.5): 23154.27
ACD/KOC (pH 5.5): 46322.14
ACD/LogD (pH 7.4): 6.05
ACD/BCF (pH 7.4): 23154.27
ACD/KOC (pH 7.4): 46322.14
Polar Surface Area: 26 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 308.1±3.0 cm3

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