ChemSpider 2D Image | (3S)-3-Benzyl-7-hydroxy-2-benzofuran-1(3H)-one | C15H12O3

(3S)-3-Benzyl-7-hydroxy-2-benzofuran-1(3H)-one

  • Molecular FormulaC15H12O3
  • Average mass240.254 Da
  • Monoisotopic mass240.078644 Da
  • ChemSpider ID74158326

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Benzyl-7-hydroxy-2-benzofuran-1(3H)-on [German] [ACD/IUPAC Name]
(3S)-3-Benzyl-7-hydroxy-2-benzofuran-1(3H)-one [ACD/IUPAC Name]
(3S)-3-Benzyl-7-hydroxy-2-benzofuran-1(3H)-one [French] [ACD/IUPAC Name]
1(3H)-Isobenzofuranone, 7-hydroxy-3-(phenylmethyl)-, (3S)- [ACD/Index 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: 439.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.3±3.0 kJ/mol
Flash Point: 192.6±21.5 °C
Index of Refraction: 1.649
Molar Refractivity: 66.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 4.03
ACD/BCF (pH 5.5): 675.46
ACD/KOC (pH 5.5): 3689.97
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 673.19
ACD/KOC (pH 7.4): 3677.57
Polar Surface Area: 47 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 58.3±3.0 dyne/cm
Molar Volume: 182.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement