ChemSpider 2D Image | 5,6-Dimethyl-4-phenyl-2H-pyran-2-one | C13H12O2

5,6-Dimethyl-4-phenyl-2H-pyran-2-one

  • Molecular FormulaC13H12O2
  • Average mass200.233 Da
  • Monoisotopic mass200.083725 Da
  • ChemSpider ID30657651

More details:

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

2H-Pyran-2-one, 5,6-dimethyl-4-phenyl- [ACD/Index Name]
5,6-Dimethyl-4-phenyl-2H-pyran-2-on [German] [ACD/IUPAC Name]
5,6-Dimethyl-4-phenyl-2H-pyran-2-one [ACD/IUPAC Name]
5,6-Diméthyl-4-phényl-2H-pyran-2-one [French] [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: 347.0±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.1±3.0 kJ/mol
Flash Point: 144.4±22.2 °C
Index of Refraction: 1.561
Molar Refractivity: 57.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.18
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 120.99
ACD/KOC (pH 5.5): 1077.55
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 120.99
ACD/KOC (pH 7.4): 1077.55
Polar Surface Area: 26 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 38.1±3.0 dyne/cm
Molar Volume: 178.7±3.0 cm3

Click to predict properties on the Chemicalize site


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