ChemSpider 2D Image | 1,6-Bis(4,5-dihydroxy-10-oxo-9,10-dihydro-9-anthracenyl)-1,6-hexanedione | C34H26O8

1,6-Bis(4,5-dihydroxy-10-oxo-9,10-dihydro-9-anthracenyl)-1,6-hexanedione

  • Molecular FormulaC34H26O8
  • Average mass562.565 Da
  • Monoisotopic mass562.162781 Da
  • ChemSpider ID327949

More details:

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

1,6-Bis(4,5-dihydroxy-10-oxo-9,10-dihydro-9-anthracenyl)-1,6-hexandion [German] [ACD/IUPAC Name]
1,6-Bis(4,5-dihydroxy-10-oxo-9,10-dihydro-9-anthracenyl)-1,6-hexanedione [ACD/IUPAC Name]
1,6-Bis(4,5-dihydroxy-10-oxo-9,10-dihydro-9-anthracényl)-1,6-hexanedione [French] [ACD/IUPAC Name]
1,6-Hexanedione, 1,6-bis(9,10-dihydro-4,5-dihydroxy-10-oxo-9-anthracenyl)- [ACD/Index Name]

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

AIDS137280 [DBID]
AIDS-137280 [DBID]
NCI60_013834 [DBID]
NSC641175 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 831.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 125.0±3.0 kJ/mol
Flash Point: 470.6±30.8 °C
Index of Refraction: 1.707
Molar Refractivity: 150.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.82
ACD/LogD (pH 5.5): 6.11
ACD/BCF (pH 5.5): 25255.59
ACD/KOC (pH 5.5): 48247.79
ACD/LogD (pH 7.4): 4.70
ACD/BCF (pH 7.4): 991.30
ACD/KOC (pH 7.4): 1893.76
Polar Surface Area: 149 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 75.5±3.0 dyne/cm
Molar Volume: 385.8±3.0 cm3

Click to predict properties on the Chemicalize site


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