ChemSpider 2D Image | 7,8,10,11,13,14-Hexahydroxy-4-(hydroxymethyl)-3-methyl-8,11-dihydrophenanthro[1,10,9,8-opqra]perylene-1,6-dione | C30H18O9

7,8,10,11,13,14-Hexahydroxy-4-(hydroxymethyl)-3-methyl-8,11-dihydrophenanthro[1,10,9,8-opqra]perylene-1,6-dione

  • Molecular FormulaC30H18O9
  • Average mass522.458 Da
  • Monoisotopic mass522.095093 Da
  • ChemSpider ID111251557

More details:

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

7,8,10,11,13,14-Hexahydroxy-4-(hydroxymethyl)-3-methyl-8,11-dihydrophenanthro[1,10,9,8-opqra]perylen-1,6-dion [German] [ACD/IUPAC Name]
7,8,10,11,13,14-Hexahydroxy-4-(hydroxymethyl)-3-methyl-8,11-dihydrophenanthro[1,10,9,8-opqra]perylene-1,6-dione [ACD/IUPAC Name]
7,8,10,11,13,14-Hexahydroxy-4-(hydroxyméthyl)-3-méthyl-8,11-dihydrophénanthro[1,10,9,8-opqra]pérylène-1,6-dione [French] [ACD/IUPAC Name]
Phenanthro[1,10,9,8-opqra]perylene-1,6-dione, 8,11-dihydro-7,8,10,11,13,14-hexahydroxy-4-(hydroxymethyl)-3-methyl- [ACD/Index Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 974.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 148.8±3.0 kJ/mol
Flash Point: 557.1±30.8 °C
Index of Refraction: 2.134
Molar Refractivity: 140.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 3
ACD/LogP: 5.27
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 754.80
ACD/KOC (pH 5.5): 3962.77
ACD/LogD (pH 7.4): 3.53
ACD/BCF (pH 7.4): 204.58
ACD/KOC (pH 7.4): 1074.04
Polar Surface Area: 176 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 169.6±3.0 dyne/cm
Molar Volume: 259.9±3.0 cm3

Click to predict properties on the Chemicalize site


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