ChemSpider 2D Image | 1,7,9,11-Tetrahydroxy-3-(2-oxopropyl)-5,6-dihydrobenzo[a]tetracene-8,13-dione | C25H18O7

1,7,9,11-Tetrahydroxy-3-(2-oxopropyl)-5,6-dihydrobenzo[a]tetracene-8,13-dione

  • Molecular FormulaC25H18O7
  • Average mass430.406 Da
  • Monoisotopic mass430.105255 Da
  • ChemSpider ID58982023

More details:

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

1,7,9,11-Tetrahydroxy-3-(2-oxopropyl)-5,6-dihydrobenzo[a]tetracen-8,13-dion [German] [ACD/IUPAC Name]
1,7,9,11-Tetrahydroxy-3-(2-oxopropyl)-5,6-dihydrobenzo[a]tetracene-8,13-dione [ACD/IUPAC Name]
1,7,9,11-Tétrahydroxy-3-(2-oxopropyl)-5,6-dihydrobenzo[a]tétracène-8,13-dione [French] [ACD/IUPAC Name]
Benzo[a]naphthacene-8,13-dione, 5,6-dihydro-1,7,9,11-tetrahydroxy-3-(2-oxopropyl)- [ACD/Index Name]
1643121-43-0 [RN]
Buanquinone

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

Density: 1.6±0.1 g/cm3
Boiling Point: 776.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 117.0±3.0 kJ/mol
Flash Point: 437.6±29.4 °C
Index of Refraction: 1.752
Molar Refractivity: 112.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.87
ACD/LogD (pH 5.5): 4.97
ACD/BCF (pH 5.5): 2676.42
ACD/KOC (pH 5.5): 7182.10
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 2.54
ACD/KOC (pH 7.4): 6.81
Polar Surface Area: 132 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 85.3±3.0 dyne/cm
Molar Volume: 275.9±3.0 cm3

Click to predict properties on the Chemicalize site


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