ChemSpider 2D Image | 4,4',5,5'-Tetrahydroxy-2'-methyl-10,10'-dioxo-9,9',10,10'-tetrahydro-9,9'-bianthracene-2-carboxylic acid | C30H20O8

4,4',5,5'-Tetrahydroxy-2'-methyl-10,10'-dioxo-9,9',10,10'-tetrahydro-9,9'-bianthracene-2-carboxylic acid

  • Molecular FormulaC30H20O8
  • Average mass508.475 Da
  • Monoisotopic mass508.115814 Da
  • ChemSpider ID4478878

More details:






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

[9,9'-Bianthracene]-2-carboxylic acid, 9,9',10,10'-tetrahydro-4,4',5,5'-tetrahydroxy-2'-methyl-10,10'-dioxo- [ACD/Index Name]
4,4',5,5'-Tetrahydroxy-2'-methyl-10,10'-dioxo-9,9',10,10'-tetrahydro-9,9'-bianthracen-2-carbonsäure [German] [ACD/IUPAC Name]
4,4',5,5'-Tetrahydroxy-2'-methyl-10,10'-dioxo-9,9',10,10'-tetrahydro-9,9'-bianthracene-2-carboxylic acid [ACD/IUPAC Name]
Acide 4,4',5,5'-tétrahydroxy-2'-méthyl-10,10'-dioxo-9,9',10,10'-tétrahydro-9,9'-bianthracène-2-carboxylique [French] [ACD/IUPAC Name]
9-(4,5-dihydroxy-2-methyl-10-oxo-9,10-dihydroanthracen-9-yl)-4,5-dihydroxy-10-oxo-9,10-dihydroanthracene-2-carboxylic acid
9-(4,5-dihydroxy-2-methyl-10-oxo-9H-anthracen-9-yl)-4,5-dihydroxy-10-oxo-9H-anthracene-2-carboxylic acid
Reidin B
Rheidin B

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

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

Density: 1.6±0.1 g/cm3
Boiling Point: 731.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 112.1±3.0 kJ/mol
Flash Point: 410.1±29.4 °C
Index of Refraction: 1.777
Molar Refractivity: 134.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 3
ACD/LogP: 8.68
ACD/LogD (pH 5.5): 5.29
ACD/BCF (pH 5.5): 1925.34
ACD/KOC (pH 5.5): 1982.48
ACD/LogD (pH 7.4): 3.49
ACD/BCF (pH 7.4): 30.68
ACD/KOC (pH 7.4): 31.59
Polar Surface Area: 152 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 88.4±3.0 dyne/cm
Molar Volume: 321.3±3.0 cm3

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