ChemSpider 2D Image | 3,8,9,10-Tetrahydroxy-6-methyl-1(4H)-anthracenone | C15H12O5

3,8,9,10-Tetrahydroxy-6-methyl-1(4H)-anthracenone

  • Molecular FormulaC15H12O5
  • Average mass272.253 Da
  • Monoisotopic mass272.068481 Da
  • ChemSpider ID88293896

More details:

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

1(4H)-Anthracenone, 3,8,9,10-tetrahydroxy-6-methyl- [ACD/Index Name]
3,8,9,10-Tetrahydroxy-6-methyl-1(4H)-anthracenon [German] [ACD/IUPAC Name]
3,8,9,10-Tetrahydroxy-6-methyl-1(4H)-anthracenone [ACD/IUPAC Name]
3,8,9,10-Tétrahydroxy-6-méthyl-1(4H)-anthracénone [French] [ACD/IUPAC Name]
3,8,9,10-tetrahydroxy-6-methyl-1,4-dihydroanthracen-1-one
3,8,9,10-tetrahydroxy-6-methyl-4H-anthracen-1-one
3,8,9,10-tetrahydroxy-6-methylanthracen-1(4H)-one
  • Miscellaneous

    • Chemical Class:

      A member of the class of anthracenones that is anthracen-1(4H)-one substituted by a methyl group at position 6 and by hydroxy groups at positions 3, 8, 9 and 10, respectively. ChEBI CHEBI:150020

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

Density: 1.6±0.1 g/cm3
Boiling Point: 644.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.9±3.0 kJ/mol
Flash Point: 357.6±28.0 °C
Index of Refraction: 1.822
Molar Refractivity: 72.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 2.15
ACD/KOC (pH 5.5): 25.66
ACD/LogD (pH 7.4): -1.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 100.2±3.0 dyne/cm
Molar Volume: 166.7±3.0 cm3

Click to predict properties on the Chemicalize site


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