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

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

  • Molecular FormulaC30H16O8
  • Average mass504.443 Da
  • Monoisotopic mass504.084503 Da
  • ChemSpider ID78432577

More details:

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

7,8,10,11,13,14-Hexahydroxy-3,4-dimethylphenanthro[1,10,9,8-opqra]perylen-1,6-dion [German] [ACD/IUPAC Name]
7,8,10,11,13,14-Hexahydroxy-3,4-dimethylphenanthro[1,10,9,8-opqra]perylene-1,6-dione [ACD/IUPAC Name]
7,8,10,11,13,14-Hexahydroxy-3,4-diméthylphénanthro[1,10,9,8-opqra]pérylène-1,6-dione [French] [ACD/IUPAC Name]
Phenanthro[1,10,9,8-opqra]perylene-1,6-dione, 7,8,10,11,13,14-hexahydroxy-3,4-dimethyl- [ACD/Index Name]
548-04-9 [RN]
Hypericin [Wiki]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 822.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 123.7±3.0 kJ/mol
Flash Point: 465.1±30.8 °C
Index of Refraction: 2.157
Molar Refractivity: 145.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 3
ACD/LogP: 5.00
ACD/LogD (pH 5.5): 4.74
ACD/BCF (pH 5.5): 1802.05
ACD/KOC (pH 5.5): 5405.42
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 3.13
ACD/KOC (pH 7.4): 9.40
Polar Surface Area: 156 Å2
Polarizability: 57.6±0.5 10-24cm3
Surface Tension: 144.0±3.0 dyne/cm
Molar Volume: 264.7±3.0 cm3

Click to predict properties on the Chemicalize site


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