ChemSpider 2D Image | 2-Benzyl-3-hydroxy-2-cyclohexen-1-one | C13H14O2

2-Benzyl-3-hydroxy-2-cyclohexen-1-one

  • Molecular FormulaC13H14O2
  • Average mass202.249 Da
  • Monoisotopic mass202.099380 Da
  • ChemSpider ID30658817

More details:

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

2-Benzyl-3-hydroxy-2-cyclohexen-1-on [German] [ACD/IUPAC Name]
2-Benzyl-3-hydroxy-2-cyclohexen-1-one [ACD/IUPAC Name]
2-Benzyl-3-hydroxy-2-cyclohexén-1-one [French] [ACD/IUPAC Name]
2-Cyclohexen-1-one, 3-hydroxy-2-(phenylmethyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 360.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.9±3.0 kJ/mol
Flash Point: 153.6±20.5 °C
Index of Refraction: 1.611
Molar Refractivity: 58.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 20.02
ACD/KOC (pH 5.5): 253.90
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.51
Polar Surface Area: 37 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 55.4±3.0 dyne/cm
Molar Volume: 167.5±3.0 cm3

Click to predict properties on the Chemicalize site


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