ChemSpider 2D Image | Thunberginol F | C15H10O5

Thunberginol F

  • Molecular FormulaC15H10O5
  • Average mass270.237 Da
  • Monoisotopic mass270.052826 Da
  • ChemSpider ID26233366
  • Double-bond stereo - Double-bond stereo


More details:






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

(3E)-3-(3,4-Dihydroxybenzyliden)-7-hydroxy-2-benzofuran-1(3H)-on [German] [ACD/IUPAC Name]
(3E)-3-(3,4-Dihydroxybenzylidene)-7-hydroxy-2-benzofuran-1(3H)-one [ACD/IUPAC Name]
(3E)-3-(3,4-Dihydroxybenzylidène)-7-hydroxy-2-benzofuran-1(3H)-one [French] [ACD/IUPAC Name]
1(3H)-Isobenzofuranone, 3-[(3,4-dihydroxyphenyl)methylene]-7-hydroxy-, (3E)- [ACD/Index Name]
Thunberginol F [Wiki]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 547.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 213.7±23.6 °C
Index of Refraction: 1.793
Molar Refractivity: 71.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): 3.09
ACD/BCF (pH 5.5): 131.24
ACD/KOC (pH 5.5): 1139.63
ACD/LogD (pH 7.4): 2.88
ACD/BCF (pH 7.4): 80.01
ACD/KOC (pH 7.4): 694.73
Polar Surface Area: 87 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 90.3±3.0 dyne/cm
Molar Volume: 169.1±3.0 cm3

Click to predict properties on the Chemicalize site





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