ChemSpider 2D Image | 4,5-Dimethoxy-7-methyl-9,10-dioxo-9,10-dihydro-2-anthracenyl 2,3-di-O-acetyl-6-deoxy-alpha-L-mannopyranoside | C27H28O11

4,5-Dimethoxy-7-methyl-9,10-dioxo-9,10-dihydro-2-anthracenyl 2,3-di-O-acetyl-6-deoxy-α-L-mannopyranoside

  • Molecular FormulaC27H28O11
  • Average mass528.505 Da
  • Monoisotopic mass528.163147 Da
  • ChemSpider ID25033051

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,3-Di-O-acétyl-6-désoxyhexopyranoside de 4,5-diméthoxy-7-méthyl-9,10-dioxo-9,10-dihydro-2-anthracényle [French] [ACD/IUPAC Name]
4,5-Dimethoxy-7-methyl-9,10-dioxo-9,10-dihydro-2-anthracenyl 2,3-di-O-acetyl-6-deoxy-α-L-mannopyranoside [ACD/IUPAC Name]
4,5-Dimethoxy-7-methyl-9,10-dioxo-9,10-dihydro-2-anthracenyl-2,3-di-O-acetyl-6-desoxyhexopyranosid [German] [ACD/IUPAC Name]
9,10-Anthracenedione, 3-[(2,3-di-O-acetyl-6-deoxy-α-L-mannopyranosyl)oxy]-1,8-dimethoxy-6-methyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 697.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.2±3.0 kJ/mol
Flash Point: 230.7±25.0 °C
Index of Refraction: 1.599
Molar Refractivity: 129.1±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 97.47
ACD/KOC (pH 5.5): 923.11
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 97.47
ACD/KOC (pH 7.4): 923.10
Polar Surface Area: 144 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 61.6±5.0 dyne/cm
Molar Volume: 377.8±5.0 cm3

Click to predict properties on the Chemicalize site


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