ChemSpider 2D Image | 1,4,9,12a-Tetrahydroxy-1,2,11,12,12a,12b-hexahydro-3,10-perylenedione | C20H16O6

1,4,9,12a-Tetrahydroxy-1,2,11,12,12a,12b-hexahydro-3,10-perylenedione

  • Molecular FormulaC20H16O6
  • Average mass352.337 Da
  • Monoisotopic mass352.094696 Da
  • ChemSpider ID26286836

More details:

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

1,4,9,12a-Tetrahydroxy-1,2,11,12,12a,12b-hexahydro-3,10-perylendion [German] [ACD/IUPAC Name]
1,4,9,12a-Tetrahydroxy-1,2,11,12,12a,12b-hexahydro-3,10-perylenedione [ACD/IUPAC Name]
1,4,9,12a-Tétrahydroxy-1,2,11,12,12a,12b-hexahydro-3,10-pérylènedione [French] [ACD/IUPAC Name]
3,10-Perylenedione, 1,2,11,12,12a,12b-hexahydro-1,4,9,12a-tetrahydroxy- [ACD/Index Name]
(1S,12AR,12BS)-1,4,9,12A-TETRAHYDROXY-1,2,11,12,12A,12B-HEXAHYDROPERYLENE-3,10-DIONE
1,4,9,12a-Tetrahydroxy-3,10-dioxo-1,2,3,10,11,12,12a,12b-octahydroperylene
Altertoxin I

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

Density: 1.7±0.1 g/cm3
Boiling Point: 699.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.6±3.0 kJ/mol
Flash Point: 391.0±28.0 °C
Index of Refraction: 1.808
Molar Refractivity: 89.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 189.54
ACD/KOC (pH 5.5): 1478.58
ACD/LogD (pH 7.4): 2.89
ACD/BCF (pH 7.4): 73.28
ACD/KOC (pH 7.4): 571.66
Polar Surface Area: 115 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 107.3±3.0 dyne/cm
Molar Volume: 208.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement