ChemSpider 2D Image | 1,2,8-Trihydroxy-6-methyl-9,10-anthraquinone | C15H10O5

1,2,8-Trihydroxy-6-methyl-9,10-anthraquinone

  • Molecular FormulaC15H10O5
  • Average mass270.237 Da
  • Monoisotopic mass270.052826 Da
  • ChemSpider ID23315170

More details:

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

1,2,8-Trihydroxy-6-methyl-9,10-anthrachinon [German] [ACD/IUPAC Name]
1,2,8-Trihydroxy-6-methyl-9,10-anthraquinone [ACD/IUPAC Name]
1,2,8-Trihydroxy-6-méthyl-9,10-anthraquinone [French] [ACD/IUPAC Name]
1,2,8-trihydroxy-6-methylanthracene-9,10-dione
9,10-Anthracenedione, 1,2,8-trihydroxy-6-methyl- [ACD/Index Name]
1,2,8-trihydroxy-6-methylanthra-9,10-quinone
1,2,8-trihydroxy-6-methylanthraquinone
478-46-6 [RN]
nataloe emodin
nataloe-emodin
  • Miscellaneous

    • Chemical Class:

      A trihydroxyanthraquinone that is 9,10-anthraquinone which is substituted by hydroxy groups at positions 1, 2, and 8 and by a methyl group at position 6. It is isolated from the leaves of Picramnia se llowii and Picramnia latifolia plants. ChEBI CHEBI:152054

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

Density: 1.6±0.1 g/cm3
Boiling Point: 503.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.2±3.0 kJ/mol
Flash Point: 272.3±26.6 °C
Index of Refraction: 1.745
Molar Refractivity: 69.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.15
ACD/LogD (pH 5.5): 3.84
ACD/BCF (pH 5.5): 454.26
ACD/KOC (pH 5.5): 2571.11
ACD/LogD (pH 7.4): 1.97
ACD/BCF (pH 7.4): 6.22
ACD/KOC (pH 7.4): 35.22
Polar Surface Area: 95 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 85.4±3.0 dyne/cm
Molar Volume: 170.6±3.0 cm3

Click to predict properties on the Chemicalize site


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