ChemSpider 2D Image | 3,5-Dimethoxy-9-oxo-9H-xanthen-1-yl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside | C27H32O15

3,5-Dimethoxy-9-oxo-9H-xanthen-1-yl 6-O-β-D-glucopyranosyl-β-D-glucopyranoside

  • Molecular FormulaC27H32O15
  • Average mass596.534 Da
  • Monoisotopic mass596.174133 Da
  • ChemSpider ID30819956

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

3,5-Dimethoxy-9-oxo-9H-xanthen-1-yl 6-O-β-D-glucopyranosyl-β-D-glucopyranoside [ACD/IUPAC Name]
3,5-Dimethoxy-9-oxo-9H-xanthen-1-yl-6-O-β-D-glucopyranosyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
6-O-β-D-Glucopyranosyl-β-D-glucopyranoside de 3,5-diméthoxy-9-oxo-9H-xanthén-1-yle [French] [ACD/IUPAC Name]
9H-Xanthen-9-one, 1-[(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-3,5-dimethoxy- [ACD/Index Name]
1444411-75-9 [RN]
Kouitchenside G

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

Density: 1.7±0.1 g/cm3
Boiling Point: 919.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 140.1±3.0 kJ/mol
Flash Point: 304.7±27.8 °C
Index of Refraction: 1.687
Molar Refractivity: 137.6±0.4 cm3
#H bond acceptors: 15
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -1.12
ACD/LogD (pH 5.5): -1.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.58
ACD/LogD (pH 7.4): -1.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.58
Polar Surface Area: 223 Å2
Polarizability: 54.5±0.5 10-24cm3
Surface Tension: 94.7±5.0 dyne/cm
Molar Volume: 361.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement