ChemSpider 2D Image | 3-[(2,6-Dideoxyhexopyranosyl)oxy]-12,14-dihydroxycard-20(22)-enolide | C29H44O8

3-[(2,6-Dideoxyhexopyranosyl)oxy]-12,14-dihydroxycard-20(22)-enolide

  • Molecular FormulaC29H44O8
  • Average mass520.655 Da
  • Monoisotopic mass520.303589 Da
  • ChemSpider ID106996

More details:

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

249-080-0 [EINECS]
28553-21-1 [RN]
3-[(2,6-Dideoxyhexopyranosyl)oxy]-12,14-dihydroxycard-20(22)-enolide [ACD/IUPAC Name]
3-[(2,6-Didesoxyhexopyranosyl)oxy]-12,14-dihydroxycard-20(22)-enolid [German] [ACD/IUPAC Name]
3-[(2,6-Didésoxyhexopyranosyl)oxy]-12,14-dihydroxycard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3-[(2,6-dideoxyhexopyranosyl)oxy]-12,14-dihydroxy- [ACD/Index Name]
3β,12β,14-trihydroxy-5β-card-20(22)-enolide, monodigitoxoside

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

Density: 1.3±0.1 g/cm3
Boiling Point: 708.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 118.4±6.0 kJ/mol
Flash Point: 230.5±26.4 °C
Index of Refraction: 1.600
Molar Refractivity: 135.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 1.07
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.44
ACD/KOC (pH 5.5): 131.98
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.44
ACD/KOC (pH 7.4): 131.98
Polar Surface Area: 126 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 60.6±5.0 dyne/cm
Molar Volume: 394.8±5.0 cm3

Click to predict properties on the Chemicalize site


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