ChemSpider 2D Image | 5-Hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-7-methoxy-4-oxo-4H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside | C24H26O12

5-Hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-7-methoxy-4-oxo-4H-chromen-3-yl 6-deoxy-α-L-mannopyranoside

  • Molecular FormulaC24H26O12
  • Average mass506.456 Da
  • Monoisotopic mass506.142426 Da
  • ChemSpider ID9148423

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

4H-1-Benzopyran-4-one, 3-[(6-deoxy-α-L-mannopyranosyl)oxy]-5-hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-7-methoxy- [ACD/Index Name]
5-Hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-7-methoxy-4-oxo-4H-chromen-3-yl 6-deoxy-α-L-mannopyranoside [ACD/IUPAC Name]
5-Hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-7-methoxy-4-oxo-4H-chromen-3-yl-6-desoxy-α-L-mannopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-α-L-mannopyranoside de 5-hydroxy-2-(3-hydroxy-4,5-diméthoxyphényl)-7-méthoxy-4-oxo-4H-chromén-3-yle [French] [ACD/IUPAC 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: 795.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.3±3.0 kJ/mol
Flash Point: 271.9±26.4 °C
Index of Refraction: 1.674
Molar Refractivity: 120.5±0.4 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 2.58
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 7.62
ACD/KOC (pH 5.5): 137.29
ACD/LogD (pH 7.4): 0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.76
Polar Surface Area: 174 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 83.5±5.0 dyne/cm
Molar Volume: 321.2±5.0 cm3

Click to predict properties on the Chemicalize site


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