ChemSpider 2D Image | flavonol 3-O-D-xylosyl-D-glucoside | C26H28O12

flavonol 3-O-D-xylosyl-D-glucoside

  • Molecular FormulaC26H28O12
  • Average mass532.493 Da
  • Monoisotopic mass532.158081 Da
  • ChemSpider ID20570093

  • defined stereocentres - 7 of 9 defined stereocentres

More details:

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

4H-1-Benzopyran-4-one, 2-phenyl-3-[(6-O-D-xylopyranosyl-D-glucopyranosyl)oxy]- [ACD/Index Name]
4-Oxo-2-phenyl-4H-chromen-3-yl 6-O-D-xylopyranosyl-D-glucopyranoside [ACD/IUPAC Name]
4-Oxo-2-phenyl-4H-chromen-3-yl-6-O-D-xylopyranosyl-D-glucopyranosid [German] [ACD/IUPAC Name]
6-O-D-Xylopyranosyl-D-glucopyranoside de 4-oxo-2-phényl-4H-chromén-3-yle [French] [ACD/IUPAC Name]
flavonol 3-O-D-xylosyl-D-glucoside
Flavonol 3-O-D-xylosylglucoside

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

Density: 1.6±0.1 g/cm3
Boiling Point: 812.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 123.8±3.0 kJ/mol
Flash Point: 274.5±27.8 °C
Index of Refraction: 1.698
Molar Refractivity: 127.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 2.09
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.78
ACD/LogD (pH 7.4): -0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.78
Polar Surface Area: 185 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 90.3±5.0 dyne/cm
Molar Volume: 330.5±5.0 cm3

Click to predict properties on the Chemicalize site


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