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Search term: 78434966 (Found by CSID)
ChemSpider 2D Image | 1',2,4,5,6',9'-Hexahydroxy-3'-methoxy-6',7-dimethyl-6',7'-dihydro-1,2'-bianthracene-8',9,10(5'H)-trione | C31H24O10

1',2,4,5,6',9'-Hexahydroxy-3'-methoxy-6',7-dimethyl-6',7'-dihydro-1,2'-bianthracene-8',9,10(5'H)-trione

  • Molecular FormulaC31H24O10
  • Average mass556.516 Da
  • Monoisotopic mass556.136963 Da
  • ChemSpider ID78434966

More details:

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

[1,2'-Bianthracene]-8',9,10(5'H)-trione, 6',7'-dihydro-1',2,4,5,6',9'-hexahydroxy-3'-methoxy-6',7-dimethyl- [ACD/Index Name]
1',2,4,5,6',9'-Hexahydroxy-3'-methoxy-6',7-dimethyl-6',7'-dihydro-1,2'-bianthracen-8',9,10(5'H)-trion [German] [ACD/IUPAC Name]
1',2,4,5,6',9'-Hexahydroxy-3'-methoxy-6',7-dimethyl-6',7'-dihydro-1,2'-bianthracene-8',9,10(5'H)-trione [ACD/IUPAC Name]
1',2,4,5,6',9'-Hexahydroxy-3'-méthoxy-6',7-diméthyl-6',7'-dihydro-1,2'-bianthracène-8',9,10(5'H)-trione [French] [ACD/IUPAC Name]
Diaporthemin B

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

Density: 1.6±0.1 g/cm3
Boiling Point: 859.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 130.8±3.0 kJ/mol
Flash Point: 286.7±27.8 °C
Index of Refraction: 1.769
Molar Refractivity: 145.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 4
ACD/LogP: 5.98
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 76.20
ACD/KOC (pH 5.5): 202.89
ACD/LogD (pH 7.4): 0.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 182 Å2
Polarizability: 57.5±0.5 10-24cm3
Surface Tension: 87.9±3.0 dyne/cm
Molar Volume: 349.6±3.0 cm3

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