ChemSpider 2D Image | 1,8-Dihydroxy-3-(hydroxymethyl)-9,10-(2,4,5,7-~2~H_4_)anthracenedione | C15H6D4O5

1,8-Dihydroxy-3-(hydroxymethyl)-9,10-(2,4,5,7-2H4)anthracenedione

  • Molecular FormulaC15H6D4O5
  • Average mass274.262 Da
  • Monoisotopic mass274.077942 Da
  • ChemSpider ID107438998

  • Non-standard isotope - Non-standard isotope

More details:

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

1,8-Dihydroxy-3-(hydroxymethyl)-9,10-(2,4,5,7-2H4)anthracendion [German] [ACD/IUPAC Name]
1,8-Dihydroxy-3-(hydroxymethyl)-9,10-(2,4,5,7-2H4)anthracenedione [ACD/IUPAC Name]
1,8-Dihydroxy-3-(hydroxyméthyl)-9,10-(2,4,5,7-2H4)anthracènedione [French] [ACD/IUPAC Name]
9,10-Anthracenedione-1,3,6,8-d4, 4,5-dihydroxy-2-(hydroxymethyl)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 568.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.8±3.0 kJ/mol
Flash Point: 311.9±26.6 °C
Index of Refraction: 1.746
Molar Refractivity: 68.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.38
ACD/LogD (pH 5.5): 2.88
ACD/BCF (pH 5.5): 86.35
ACD/KOC (pH 5.5): 799.66
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 1.95
ACD/KOC (pH 7.4): 18.01
Polar Surface Area: 95 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 88.5±3.0 dyne/cm
Molar Volume: 169.7±3.0 cm3

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