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ChemSpider 2D Image | Hippuristanol | C28H46O5


  • Molecular FormulaC28H46O5
  • Average mass462.662 Da
  • Monoisotopic mass462.334534 Da
  • ChemSpider ID21105577
  • defined stereocentres - 13 of 13 defined stereocentres

More details:

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

Hippuristanol [Wiki]
Furostan-3,11,20-triol, 22,25-epoxy-24-methyl-, (3α,5α,11β,22α,24S)- [ACD/Index Name]

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

Density: 1.2±0.0 g/cm3
Boiling Point: 583.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 100.0±0.0 kJ/mol
Flash Point: 306.4±0.0 °C
Index of Refraction: 1.574
Molar Refractivity: 127.4±0.0 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 4.73
ACD/BCF (pH 5.5): 2327.71
ACD/KOC (pH 5.5): 8946.31
ACD/LogD (pH 7.4): 4.73
ACD/BCF (pH 7.4): 2327.71
ACD/KOC (pH 7.4): 8946.31
Polar Surface Area: 79 Å2
Polarizability: 50.5±0.0 10-24cm3
Surface Tension: 50.7±0.0 dyne/cm
Molar Volume: 385.8±0.0 cm3

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