ChemSpider 2D Image | 3,4,6,8,13,14-Hexahydroxy-10,11-dimethylphenanthro[1,10,9,8-opqra]perylene-1,7-dione | C30H16O8

3,4,6,8,13,14-Hexahydroxy-10,11-dimethylphenanthro[1,10,9,8-opqra]perylene-1,7-dione

  • Molecular FormulaC30H16O8
  • Average mass504.443 Da
  • Monoisotopic mass504.084503 Da
  • ChemSpider ID128948739

More details:

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

3,4,6,8,13,14-Hexahydroxy-10,11-dimethylphenanthro[1,10,9,8-opqra]perylen-1,7-dion [German] [ACD/IUPAC Name]
3,4,6,8,13,14-Hexahydroxy-10,11-dimethylphenanthro[1,10,9,8-opqra]perylene-1,7-dione [ACD/IUPAC Name]
3,4,6,8,13,14-Hexahydroxy-10,11-diméthylphénanthro[1,10,9,8-opqra]pérylène-1,7-dione [French] [ACD/IUPAC Name]
Phenanthro[1,10,9,8-opqra]perylene-1,7-dione, 3,4,6,8,13,14-hexahydroxy-10,11-dimethyl- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 845.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 127.1±3.0 kJ/mol
Flash Point: 479.0±30.8 °C
Index of Refraction: 2.179
Molar Refractivity: 143.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 3
ACD/LogP: 7.07
ACD/LogD (pH 5.5): 4.36
ACD/BCF (pH 5.5): 345.69
ACD/KOC (pH 5.5): 522.57
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 2.57
ACD/KOC (pH 7.4): 3.89
Polar Surface Area: 156 Å2
Polarizability: 57.0±0.5 10-24cm3
Surface Tension: 159.2±3.0 dyne/cm
Molar Volume: 258.9±3.0 cm3

Click to predict properties on the Chemicalize site


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