ChemSpider 2D Image | 5,5',7,7'-Tetrahydroxy-2-(4-hydroxyphenyl)-2'-(4-methoxyphenyl)-4H,4'H-6,8'-bichromene-4,4'-dione | C31H20O10

5,5',7,7'-Tetrahydroxy-2-(4-hydroxyphenyl)-2'-(4-methoxyphenyl)-4H,4'H-6,8'-bichromene-4,4'-dione

  • Molecular FormulaC31H20O10
  • Average mass552.484 Da
  • Monoisotopic mass552.105652 Da
  • ChemSpider ID28288051

More details:

Featured data source
Natural Product Updates

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

[6,8'-Bi-4H-1-benzopyran]-4,4'-dione, 5,5',7,7'-tetrahydroxy-2-(4-hydroxyphenyl)-2'-(4-methoxyphenyl)- [ACD/Index Name]
5,5',7,7'-Tetrahydroxy-2-(4-hydroxyphenyl)-2'-(4-methoxyphenyl)-4H,4'H-6,8'-bichromen-4,4'-dion [German] [ACD/IUPAC Name]
5,5',7,7'-Tetrahydroxy-2-(4-hydroxyphenyl)-2'-(4-methoxyphenyl)-4H,4'H-6,8'-bichromene-4,4'-dione [ACD/IUPAC Name]
5,5',7,7'-Tétrahydroxy-2-(4-hydroxyphényl)-2'-(4-méthoxyphényl)-4H,4'H-6,8'-bichromène-4,4'-dione [French] [ACD/IUPAC Name]
4'''-O-methylagathisflavone

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

Density: 1.6±0.1 g/cm3
Boiling Point: 896.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.8±3.0 kJ/mol
Flash Point: 301.0±27.8 °C
Index of Refraction: 1.750
Molar Refractivity: 142.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 3.43
ACD/BCF (pH 5.5): 154.26
ACD/KOC (pH 5.5): 759.78
ACD/LogD (pH 7.4): -0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 163 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 81.4±3.0 dyne/cm
Molar Volume: 350.5±3.0 cm3

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