ChemSpider 2D Image | 6-[4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenoxy]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one | C31H20O10

6-[4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenoxy]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one

  • Molecular FormulaC31H20O10
  • Average mass552.484 Da
  • Monoisotopic mass552.105652 Da
  • ChemSpider ID4477086

More details:

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

4H-1-Benzopyran-4-one, 6-[4-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)phenoxy]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy- [ACD/Index Name]
6-[4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenoxy]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-on [German] [ACD/IUPAC Name]
6-[4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)phenoxy]-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one [ACD/IUPAC Name]
6-[4-(5,7-Dihydroxy-4-oxo-4H-chromén-2-yl)phénoxy]-5-hydroxy-2-(4-hydroxyphényl)-7-méthoxy-4H-chromén-4-one [French] [ACD/IUPAC Name]
Isocryptomerin

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

Density: 1.5±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: 275.1±27.8 °C
Index of Refraction: 1.731
Molar Refractivity: 142.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 3.59
ACD/LogD (pH 5.5): 4.00
ACD/BCF (pH 5.5): 531.02
ACD/KOC (pH 5.5): 2482.38
ACD/LogD (pH 7.4): 1.31
ACD/BCF (pH 7.4): 1.08
ACD/KOC (pH 7.4): 5.06
Polar Surface Area: 152 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 76.8±3.0 dyne/cm
Molar Volume: 357.4±3.0 cm3

Click to predict properties on the Chemicalize site


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