ChemSpider 2D Image | 5,7-Dihydroxy-3-{4-[2-hydroxy-5-(7-hydroxy-4-oxo-4H-chromen-3-yl)phenoxy]phenyl}-4H-chromen-4-one | C30H18O9

5,7-Dihydroxy-3-{4-[2-hydroxy-5-(7-hydroxy-4-oxo-4H-chromen-3-yl)phenoxy]phenyl}-4H-chromen-4-one

  • Molecular FormulaC30H18O9
  • Average mass522.458 Da
  • Monoisotopic mass522.095093 Da
  • ChemSpider ID8025334

More details:

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

4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-[4-[2-hydroxy-5-(7-hydroxy-4-oxo-4H-1-benzopyran-3-yl)phenoxy]phenyl]- [ACD/Index Name]
5,7-Dihydroxy-3-{4-[2-hydroxy-5-(7-hydroxy-4-oxo-4H-chromen-3-yl)phenoxy]phenyl}-4H-chromen-4-on [German] [ACD/IUPAC Name]
5,7-Dihydroxy-3-{4-[2-hydroxy-5-(7-hydroxy-4-oxo-4H-chromen-3-yl)phenoxy]phenyl}-4H-chromen-4-one [ACD/IUPAC Name]
5,7-Dihydroxy-3-{4-[2-hydroxy-5-(7-hydroxy-4-oxo-4H-chromén-3-yl)phénoxy]phényl}-4H-chromén-4-one [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 802.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.7±3.0 kJ/mol
Flash Point: 272.2±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: 2
ACD/LogP: 5.54
ACD/LogD (pH 5.5): 4.55
ACD/BCF (pH 5.5): 1608.23
ACD/KOC (pH 5.5): 6474.47
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 20.83
ACD/KOC (pH 7.4): 83.88
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


Advertisement