ChemSpider 2D Image | 3a,5,12,14-Tetrahydroxy-7-methyl-10,18c-dihydronaphtho[2',3':3a,4]indeno[1,2-a]anthracene-3,4,9,13,18(3aH)-pentone | C30H18O9

3a,5,12,14-Tetrahydroxy-7-methyl-10,18c-dihydronaphtho[2',3':3a,4]indeno[1,2-a]anthracene-3,4,9,13,18(3aH)-pentone

  • Molecular FormulaC30H18O9
  • Average mass522.458 Da
  • Monoisotopic mass522.095093 Da
  • ChemSpider ID28596837

More details:

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

3a,5,12,14-Tetrahydroxy-7-methyl-10,18c-dihydronaphtho[2',3':3a,4]indeno[1,2-a]anthracen-3,4,9,13,18(3aH)-penton [German] [ACD/IUPAC Name]
3a,5,12,14-Tetrahydroxy-7-methyl-10,18c-dihydronaphtho[2',3':3a,4]indeno[1,2-a]anthracene-3,4,9,13,18(3aH)-pentone [ACD/IUPAC Name]
3a,5,12,14-Tétrahydroxy-7-méthyl-10,18c-dihydronaphto[2',3':3a,4]indéno[1,2-a]anthracène-3,4,9,13,18(3aH)-pentone [French] [ACD/IUPAC Name]
Cyclopenta[1,2-a:5,4-d']dianthracene-3,4,9,13,18(3aH)-pentone, 10,18c-dihydro-3a,5,12,14-tetrahydroxy-7-methyl- [ACD/Index Name]
10,18c-dihydro-3a,5,12,14-tetrahydroxy-7-methyl-naphth[2',3':3a,4]indeno[1,2-a]anthracene-3,4,9,13,18(3aH)-pentone

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

Density: 1.8±0.1 g/cm3
Boiling Point: 854.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 130.1±3.0 kJ/mol
Flash Point: 484.4±30.8 °C
Index of Refraction: 1.842
Molar Refractivity: 130.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 7.49
ACD/LogD (pH 5.5): 5.88
ACD/BCF (pH 5.5): 16134.73
ACD/KOC (pH 5.5): 33087.63
ACD/LogD (pH 7.4): 3.38
ACD/BCF (pH 7.4): 51.68
ACD/KOC (pH 7.4): 105.97
Polar Surface Area: 166 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 119.7±5.0 dyne/cm
Molar Volume: 293.3±5.0 cm3

Click to predict properties on the Chemicalize site


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