ChemSpider 2D Image | 6,8-Dihydroxy-3-methyl-7,12-dioxo-7,12-dihydro-1-tetraphenyl 6-deoxy-alpha-L-mannopyranoside | C25H22O9

6,8-Dihydroxy-3-methyl-7,12-dioxo-7,12-dihydro-1-tetraphenyl 6-deoxy-α-L-mannopyranoside

  • Molecular FormulaC25H22O9
  • Average mass466.437 Da
  • Monoisotopic mass466.126373 Da
  • ChemSpider ID28644929

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

6,8-Dihydroxy-3-methyl-7,12-dioxo-7,12-dihydro-1-tetraphenyl 6-deoxy-α-L-mannopyranoside [ACD/IUPAC Name]
6,8-Dihydroxy-3-methyl-7,12-dioxo-7,12-dihydro-1-tetraphenyl-6-desoxy-α-L-mannopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-α-L-mannopyranoside de 6,8-dihydroxy-3-méthyl-7,12-dioxo-7,12-dihydro-1-tétraphényle [French] [ACD/IUPAC Name]
Benz[a]anthracene-7,12-dione, 1-[(6-deoxy-α-L-mannopyranosyl)oxy]-6,8-dihydroxy-3-methyl- [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: 756.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.6±3.0 kJ/mol
Flash Point: 262.4±26.4 °C
Index of Refraction: 1.743
Molar Refractivity: 119.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 3.54
ACD/BCF (pH 5.5): 275.44
ACD/KOC (pH 5.5): 1838.06
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 12.90
ACD/KOC (pH 7.4): 86.11
Polar Surface Area: 154 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 86.5±3.0 dyne/cm
Molar Volume: 294.8±3.0 cm3

Click to predict properties on the Chemicalize site


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