ChemSpider 2D Image | (8alpha,9beta,11beta,14beta,17alpha,23S,24R)-3-Oxo-13,17-epoxydammarane-11,23,24,25-tetrayl tetrakis(methoxyacetate) | C42H66O14

(8α,9β,11β,14β,17α,23S,24R)-3-Oxo-13,17-epoxydammarane-11,23,24,25-tetrayl tetrakis(methoxyacetate)

  • Molecular FormulaC42H66O14
  • Average mass794.965 Da
  • Monoisotopic mass794.445251 Da
  • ChemSpider ID24689697
  • defined stereocentres - 11 of 11 defined stereocentres


More details:






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

(8α,9β,11β,14β,17α,23S,24R)-3-Oxo-13,17-epoxydammaran-11,23,24,25-tetrayl-tetrakis(methoxyacetat) [German] [ACD/IUPAC Name]
(8α,9β,11β,14β,17α,23S,24R)-3-Oxo-13,17-epoxydammarane-11,23,24,25-tetrayl tetrakis(methoxyacetate) [ACD/IUPAC Name]
Acetic acid, 2-methoxy-, (8α,9β,11β,14β,17α,23S,24R)-13,17-epoxy-3-oxodammarane-11,23,24,25-tetrayl ester [ACD/Index Name]
Tétrakis(méthoxyacétate) de (8α,9β,11β,14β,17α,23S,24R)-3-oxo-13,17-époxydammarane-11,23,24,25-tétrayle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 732.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.9±3.0 kJ/mol
Flash Point: 288.1±32.9 °C
Index of Refraction: 1.524
Molar Refractivity: 202.5±0.4 cm3
#H bond acceptors: 14
#H bond donors: 0
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 2
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 4.52
ACD/BCF (pH 5.5): 1603.40
ACD/KOC (pH 5.5): 6851.21
ACD/LogD (pH 7.4): 4.52
ACD/BCF (pH 7.4): 1603.40
ACD/KOC (pH 7.4): 6851.21
Polar Surface Area: 172 Å2
Polarizability: 80.3±0.5 10-24cm3
Surface Tension: 47.4±5.0 dyne/cm
Molar Volume: 661.5±5.0 cm3

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