ChemSpider 2D Image | 4,6-Dihydroxy-8a-(4-hydroxy-6-methyl-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-8,8a,12,12a-tetrahydro-5H-indeno[1,2-a]anthracene-5,9,13-trione | C30H20O8

4,6-Dihydroxy-8a-(4-hydroxy-6-methyl-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-8,8a,12,12a-tetrahydro-5H-indeno[1,2-a]anthracene-5,9,13-trione

  • Molecular FormulaC30H20O8
  • Average mass508.475 Da
  • Monoisotopic mass508.115814 Da
  • ChemSpider ID28596833

More details:

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

4,6-Dihydroxy-8a-(4-hydroxy-6-methyl-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-8,8a,12,12a-tetrahydro-5H-indeno[1,2-a]anthracen-5,9,13-trion [German] [ACD/IUPAC Name]
4,6-Dihydroxy-8a-(4-hydroxy-6-methyl-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-8,8a,12,12a-tetrahydro-5H-indeno[1,2-a]anthracene-5,9,13-trione [ACD/IUPAC Name]
4,6-Dihydroxy-8a-(4-hydroxy-6-méthyl-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-8,8a,12,12a-tétrahydro-5H-indéno[1,2-a]anthracène-5,9,13-trione [French] [ACD/IUPAC Name]
5H-Indeno[1,2-a]anthracene-5,9,13-trione, 8a-(1,3-dihydro-4-hydroxy-6-methyl-3-oxo-1-isobenzofuranyl)-8,8a,12,12a-tetrahydro-4,6-dihydroxy- [ACD/Index Name]
8a-(1,3-Dihydro-4-hydroxy-6-methyl-3-oxo-1-isobenzofuranyl)-8,8a,12,12a-tetrahydro-4,6-dihydroxy-5H-indeno[1,2-a]anthracene-5,9,13-trione

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

Density: 1.6±0.1 g/cm3
Boiling Point: 819.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 123.3±3.0 kJ/mol
Flash Point: 279.9±27.8 °C
Index of Refraction: 1.768
Molar Refractivity: 131.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 2
ACD/LogP: 6.23
ACD/LogD (pH 5.5): 5.83
ACD/BCF (pH 5.5): 15667.29
ACD/KOC (pH 5.5): 34315.32
ACD/LogD (pH 7.4): 5.02
ACD/BCF (pH 7.4): 2432.19
ACD/KOC (pH 7.4): 5327.12
Polar Surface Area: 138 Å2
Polarizability: 51.9±0.5 10-24cm3
Surface Tension: 88.8±3.0 dyne/cm
Molar Volume: 316.0±3.0 cm3

Click to predict properties on the Chemicalize site


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