ChemSpider 2D Image | (3beta,5beta)-3,8,14-Trihydroxycard-20(22)-enolide | C23H34O5

(3β,5β)-3,8,14-Trihydroxycard-20(22)-enolide

  • Molecular FormulaC23H34O5
  • Average mass390.513 Da
  • Monoisotopic mass390.240631 Da
  • ChemSpider ID28425593
  • defined stereocentres - 8 of 8 defined stereocentres


More details:






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

(3β,5β)-3,8,14-Trihydroxycard-20(22)-enolid [German] [ACD/IUPAC Name]
(3β,5β)-3,8,14-Trihydroxycard-20(22)-enolide [ACD/IUPAC Name]
(3β,5β)-3,8,14-Trihydroxycard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3,8,14-trihydroxy-, (3β,5β)- [ACD/Index Name]
1049674-06-7 [RN]
8-Hydroxydigitoxigenin
MFCD20274985

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 562.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 97.2±6.0 kJ/mol
Flash Point: 192.4±23.6 °C
Index of Refraction: 1.622
Molar Refractivity: 104.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 14.04
ACD/KOC (pH 5.5): 230.64
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 14.04
ACD/KOC (pH 7.4): 230.64
Polar Surface Area: 87 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 65.5±3.0 dyne/cm
Molar Volume: 295.8±3.0 cm3

Click to predict properties on the Chemicalize site






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