ChemSpider 2D Image | 2-(2,4-Dihydroxyphenyl)-6-{[2-(2,4-dihydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-4H-chromen-4-one | C30H18O9

2-(2,4-Dihydroxyphenyl)-6-{[2-(2,4-dihydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-4H-chromen-4-one

  • Molecular FormulaC30H18O9
  • Average mass522.458 Da
  • Monoisotopic mass522.095093 Da
  • ChemSpider ID24692131

More details:

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

2-(2,4-Dihydroxyphenyl)-6-{[2-(2,4-dihydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-4H-chromen-4-on [German] [ACD/IUPAC Name]
2-(2,4-Dihydroxyphenyl)-6-{[2-(2,4-dihydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-4H-chromen-4-one [ACD/IUPAC Name]
2-(2,4-Dihydroxyphényl)-6-{[2-(2,4-dihydroxyphényl)-4-oxo-4H-chromén-7-yl]oxy}-4H-chromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2-(2,4-dihydroxyphenyl)-6-[[2-(2,4-dihydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl]oxy]- [ACD/Index Name]
CHEMBL461230
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL461230/

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

Density: 1.6±0.1 g/cm3
Boiling Point: 821.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 123.5±3.0 kJ/mol
Flash Point: 278.9±27.8 °C
Index of Refraction: 1.752
Molar Refractivity: 136.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 4.45
ACD/LogD (pH 5.5): 3.72
ACD/BCF (pH 5.5): 393.80
ACD/KOC (pH 5.5): 2507.77
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 390.71
ACD/KOC (pH 7.4): 2488.15
Polar Surface Area: 143 Å2
Polarizability: 54.0±0.5 10-24cm3
Surface Tension: 80.7±3.0 dyne/cm
Molar Volume: 333.4±3.0 cm3

Click to predict properties on the Chemicalize site


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