ChemSpider 2D Image | 5,6,7-Trihydroxy-3-(4-hydroxybenzylidene)-8-methoxy-2,3-dihydro-4H-chromen-4-one | C17H14O7

5,6,7-Trihydroxy-3-(4-hydroxybenzylidene)-8-methoxy-2,3-dihydro-4H-chromen-4-one

  • Molecular FormulaC17H14O7
  • Average mass330.289 Da
  • Monoisotopic mass330.073944 Da
  • ChemSpider ID57641891

More details:






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

4H-1-Benzopyran-4-one, 2,3-dihydro-5,6,7-trihydroxy-3-[(4-hydroxyphenyl)methylene]-8-methoxy- [ACD/Index Name]
5,6,7-Trihydroxy-3-(4-hydroxybenzyliden)-8-methoxy-2,3-dihydro-4H-chromen-4-on [German] [ACD/IUPAC Name]
5,6,7-Trihydroxy-3-(4-hydroxybenzylidene)-8-methoxy-2,3-dihydro-4H-chromen-4-one [ACD/IUPAC Name]
5,6,7-Trihydroxy-3-(4-hydroxybenzylidène)-8-méthoxy-2,3-dihydro-4H-chromén-4-one [French] [ACD/IUPAC Name]
849727-87-3 [RN]
Poleevansin

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

Density: 1.6±0.1 g/cm3
Boiling Point: 707.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.2±3.0 kJ/mol
Flash Point: 265.6±26.4 °C
Index of Refraction: 1.747
Molar Refractivity: 85.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 34.92
ACD/KOC (pH 5.5): 435.43
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 5.75
ACD/KOC (pH 7.4): 71.71
Polar Surface Area: 116 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 84.9±3.0 dyne/cm
Molar Volume: 209.3±3.0 cm3

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