ChemSpider 2D Image | 7-Hydroxy-3,8-dimethoxy-5,10-dioxo-5,10-dihydrochromeno[5,4,3-cde]chromen-2-yl 6-deoxy-alpha-D-mannopyranoside | C22H20O12

7-Hydroxy-3,8-dimethoxy-5,10-dioxo-5,10-dihydrochromeno[5,4,3-cde]chromen-2-yl 6-deoxy-α-D-mannopyranoside

  • Molecular FormulaC22H20O12
  • Average mass476.387 Da
  • Monoisotopic mass476.095490 Da
  • ChemSpider ID52563808

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

[1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 2-[(6-deoxy-α-D-mannopyranosyl)oxy]-7-hydroxy-3,8-dimethoxy- [ACD/Index Name]
6-Désoxy-α-D-mannopyranoside de 7-hydroxy-3,8-diméthoxy-5,10-dioxo-5,10-dihydrochroméno[5,4,3-cde]chromén-2-yle [French] [ACD/IUPAC Name]
7-Hydroxy-3,8-dimethoxy-5,10-dioxo-5,10-dihydrochromeno[5,4,3-cde]chromen-2-yl 6-deoxy-α-D-mannopyranoside [ACD/IUPAC Name]
7-Hydroxy-3,8-dimethoxy-5,10-dioxo-5,10-dihydrochromeno[5,4,3-cde]chromen-2-yl-6-desoxy-α-D-mannopyranosid [German] [ACD/IUPAC Name]
80680-49-5 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 829.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 126.4±3.0 kJ/mol
Flash Point: 291.9±27.8 °C
Index of Refraction: 1.688
Molar Refractivity: 109.6±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 1.69
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 9.21
ACD/KOC (pH 5.5): 170.04
ACD/LogD (pH 7.4): 1.30
ACD/BCF (pH 7.4): 4.92
ACD/KOC (pH 7.4): 90.84
Polar Surface Area: 170 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 82.2±3.0 dyne/cm
Molar Volume: 287.4±3.0 cm3

Click to predict properties on the Chemicalize site


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