ChemSpider 2D Image | (3beta,23E)-25-Hydroperoxylanosta-8,23-diene-3,21-diol | C30H50O4

(3β,23E)-25-Hydroperoxylanosta-8,23-diene-3,21-diol

  • Molecular FormulaC30H50O4
  • Average mass474.716 Da
  • Monoisotopic mass474.370911 Da
  • ChemSpider ID78436250

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(3β,23E)-25-Hydroperoxylanosta-8,23-dien-3,21-diol [German] [ACD/IUPAC Name]
(3β,23E)-25-Hydroperoxylanosta-8,23-diene-3,21-diol [ACD/IUPAC Name]
(3β,23E)-25-Hydroperoxylanosta-8,23-diène-3,21-diol [French] [ACD/IUPAC Name]
Lanosta-8,23-diene-3,21-diol, 25-hydroperoxy-, (3β,23E)- [ACD/Index Name]
Inoterpene E

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

Density: 1.1±0.1 g/cm3
Boiling Point: 598.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 102.2±6.0 kJ/mol
Flash Point: 315.4±30.1 °C
Index of Refraction: 1.553
Molar Refractivity: 138.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.87
ACD/LogD (pH 5.5): 7.57
ACD/BCF (pH 5.5): 332669.28
ACD/KOC (pH 5.5): 312054.38
ACD/LogD (pH 7.4): 7.57
ACD/BCF (pH 7.4): 332663.44
ACD/KOC (pH 7.4): 312048.88
Polar Surface Area: 70 Å2
Polarizability: 54.9±0.5 10-24cm3
Surface Tension: 45.8±5.0 dyne/cm
Molar Volume: 432.9±5.0 cm3

Click to predict properties on the Chemicalize site


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