ChemSpider 2D Image | 1,8-Dihydroxy-3-methoxy-6-methyl-4a,9a-dihydro-9,10-anthracenedione | C16H14O5

1,8-Dihydroxy-3-methoxy-6-methyl-4a,9a-dihydro-9,10-anthracenedione

  • Molecular FormulaC16H14O5
  • Average mass286.279 Da
  • Monoisotopic mass286.084137 Da
  • ChemSpider ID30785506

More details:

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

1,8-Dihydroxy-3-methoxy-6-methyl-4a,9a-dihydro-9,10-anthracendion [German] [ACD/IUPAC Name]
1,8-Dihydroxy-3-methoxy-6-methyl-4a,9a-dihydro-9,10-anthracenedione [ACD/IUPAC Name]
1,8-Dihydroxy-3-méthoxy-6-méthyl-4a,9a-dihydro-9,10-anthracènedione [French] [ACD/IUPAC Name]
9,10-Anthracenedione, 4a,9a-dihydro-1,8-dihydroxy-3-methoxy-6-methyl- [ACD/Index Name]
1,8-Dihydroxy-3-methoxy-6-methyl-9,10-anthracenedione
1,8-dihydroxy-3-methoxy-6-methylanthracene-9,10-dione
1,8-dihydroxy-3-methoxy-6-methylanthraquinone
1,8-dihydroxy-3-methyl-6-methoxyanthraquinone
1915778 [Beilstein]
521-61-9 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 594.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 228.0±23.6 °C
Index of Refraction: 1.663
Molar Refractivity: 73.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 2.82
ACD/BCF (pH 5.5): 80.47
ACD/KOC (pH 5.5): 793.18
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 16.23
ACD/KOC (pH 7.4): 160.02
Polar Surface Area: 84 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 68.1±5.0 dyne/cm
Molar Volume: 197.9±5.0 cm3

Click to predict properties on the Chemicalize site


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