ChemSpider 2D Image | (3beta)-6-Methylspirost-5-en-3-ol | C28H44O3

(3β)-6-Methylspirost-5-en-3-ol

  • Molecular FormulaC28H44O3
  • Average mass428.647 Da
  • Monoisotopic mass428.329041 Da
  • ChemSpider ID29367466

  • defined stereocentres - 10 of 11 defined stereocentres

More details:

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

(3β)-6-Methylspirost-5-en-3-ol [German] [ACD/IUPAC Name]
(3β)-6-Methylspirost-5-en-3-ol [ACD/IUPAC Name]
(3β)-6-Méthylspirost-5-én-3-ol [French] [ACD/IUPAC Name]
Spirost-5-en-3-ol, 6-methyl-, (3β)- [ACD/Index Name]
6-Methyldiosgenin
86533-46-2 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 531.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.8±6.0 kJ/mol
Flash Point: 275.3±30.1 °C
Index of Refraction: 1.560
Molar Refractivity: 123.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 6.43
ACD/LogD (pH 5.5): 6.24
ACD/BCF (pH 5.5): 32387.96
ACD/KOC (pH 5.5): 58900.20
ACD/LogD (pH 7.4): 6.24
ACD/BCF (pH 7.4): 32387.96
ACD/KOC (pH 7.4): 58900.20
Polar Surface Area: 39 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 43.9±5.0 dyne/cm
Molar Volume: 382.9±5.0 cm3

Click to predict properties on the Chemicalize site


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