ChemSpider 2D Image | 1,1',4',5',8-Pentahydroxy-2',6-dimethyl-2,9'-bianthracene-9,10,10'(9'H)-trione | C30H20O8

1,1',4',5',8-Pentahydroxy-2',6-dimethyl-2,9'-bianthracene-9,10,10'(9'H)-trione

  • Molecular FormulaC30H20O8
  • Average mass508.475 Da
  • Monoisotopic mass508.115814 Da
  • ChemSpider ID28282554

More details:



Featured data source



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

[2,9'-Bianthracene]-9,10,10'(9'H)-trione, 1,1',4',5',8-pentahydroxy-2',6-dimethyl- [ACD/Index Name]
1,1',4',5',8-Pentahydroxy-2',6-dimethyl-2,9'-bianthracen-9,10,10'(9'H)-trion [German] [ACD/IUPAC Name]
1,1',4',5',8-Pentahydroxy-2',6-dimethyl-2,9'-bianthracene-9,10,10'(9'H)-trione [ACD/IUPAC Name]
1,1',4',5',8-Pentahydroxy-2',6-diméthyl-2,9'-bianthracène-9,10,10'(9'H)-trione [French] [ACD/IUPAC Name]
abyquinone B

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

Density: 1.6±0.1 g/cm3
Boiling Point: 695.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.6±3.0 kJ/mol
Flash Point: 388.6±28.0 °C
Index of Refraction: 1.778
Molar Refractivity: 134.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 3
ACD/LogP: 7.98
ACD/LogD (pH 5.5): 6.56
ACD/BCF (pH 5.5): 53966.75
ACD/KOC (pH 5.5): 79258.52
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 458.60
ACD/KOC (pH 7.4): 673.52
Polar Surface Area: 152 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 88.1±3.0 dyne/cm
Molar Volume: 321.1±3.0 cm3

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