ChemSpider 2D Image | 3,4-Diethyl-1,6,8,10,11,13-hexahydroxyphenanthro[1,10,9,8-opqra]perylene-7,14-dione | C32H20O8

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

  • Molecular FormulaC32H20O8
  • Average mass532.496 Da
  • Monoisotopic mass532.115845 Da
  • ChemSpider ID4576733

More details:






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

3,4-Diethyl-1,6,8,10,11,13-hexahydroxyphenanthro[1,10,9,8-opqra]perylen-7,14-dion [German] [ACD/IUPAC Name]
3,4-Diethyl-1,6,8,10,11,13-hexahydroxyphenanthro[1,10,9,8-opqra]perylene-7,14-dione [ACD/IUPAC Name]
3,4-Diéthyl-1,6,8,10,11,13-hexahydroxyphénanthro[1,10,9,8-opqra]pérylène-7,14-dione [French] [ACD/IUPAC Name]
Phenanthro[1,10,9,8-opqra]perylene-7,14-dione, 3,4-diethyl-1,6,8,10,11,13-hexahydroxy- [ACD/Index Name]
Ethylhypericin

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

AIDS122773 [DBID]
AIDS-122773 [DBID]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1006.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 151.9±3.0 kJ/mol
Flash Point: 576.2±30.8 °C
Index of Refraction: 2.039
Molar Refractivity: 152.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 3
ACD/LogP: 9.46
ACD/LogD (pH 5.5): 8.69
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1239706.63
ACD/LogD (pH 7.4): 7.95
ACD/BCF (pH 7.4): 429901.97
ACD/KOC (pH 7.4): 229227.48
Polar Surface Area: 156 Å2
Polarizability: 60.3±0.5 10-24cm3
Surface Tension: 130.6±3.0 dyne/cm
Molar Volume: 296.5±3.0 cm3

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