ChemSpider 2D Image | 8-Hydroxy-5,6-dimethoxy-9-oxo-9H-xanthen-2-yl beta-L-glucopyranoside | C21H22O11

8-Hydroxy-5,6-dimethoxy-9-oxo-9H-xanthen-2-yl β-L-glucopyranoside

  • Molecular FormulaC21H22O11
  • Average mass450.393 Da
  • Monoisotopic mass450.116211 Da
  • ChemSpider ID82827210

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

8-Hydroxy-5,6-dimethoxy-9-oxo-9H-xanthen-2-yl β-L-glucopyranoside [ACD/IUPAC Name]
8-Hydroxy-5,6-dimethoxy-9-oxo-9H-xanthen-2-yl-β-L-glucopyranosid [German] [ACD/IUPAC Name]
9H-Xanthen-9-one, 7-(β-L-glucopyranosyloxy)-1-hydroxy-3,4-dimethoxy- [ACD/Index Name]
β-L-Glucopyranoside de 8-hydroxy-5,6-diméthoxy-9-oxo-9H-xanthén-2-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: 781.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.2±3.0 kJ/mol
Flash Point: 275.8±26.4 °C
Index of Refraction: 1.664
Molar Refractivity: 106.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -0.81
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 22.34
ACD/LogD (pH 7.4): -0.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.38
Polar Surface Area: 164 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 76.8±3.0 dyne/cm
Molar Volume: 287.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement