ChemSpider 2D Image | (3beta,5alpha,24R)-4-Methyleneergosta-7,9(11),14-trien-3-ol | C29H44O

(3β,5α,24R)-4-Methyleneergosta-7,9(11),14-trien-3-ol

  • Molecular FormulaC29H44O
  • Average mass408.659 Da
  • Monoisotopic mass408.339203 Da
  • ChemSpider ID26333428

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(3β,5α,24R)-4-Methyleneergosta-7,9(11),14-trien-3-ol [ACD/IUPAC Name]
(3β,5α,24R)-4-Méthylèneergosta-7,9(11),14-trién-3-ol [French] [ACD/IUPAC Name]
(3β,5α,24R)-4-Methylenergosta-7,9(11),14-trien-3-ol [German] [ACD/IUPAC Name]
Ergosta-7,9(11),14-trien-3-ol, 4-methylene-, (3β,5α,24R)- [ACD/Index Name]
4-methylene-24R-methylcholest-7,9(11),14-trien-3β-ol
4-methylene-5α-campest-7,9(11),14-trien-3β-ol
conicasterol B

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

Density: 1.0±0.1 g/cm3
Boiling Point: 543.9±49.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 94.6±6.0 kJ/mol
Flash Point: 230.2±22.1 °C
Index of Refraction: 1.546
Molar Refractivity: 128.2±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 9.57
ACD/LogD (pH 5.5): 7.76
ACD/BCF (pH 5.5): 461672.81
ACD/KOC (pH 5.5): 394550.19
ACD/LogD (pH 7.4): 7.76
ACD/BCF (pH 7.4): 461672.81
ACD/KOC (pH 7.4): 394550.19
Polar Surface Area: 20 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 38.6±5.0 dyne/cm
Molar Volume: 404.6±5.0 cm3

Click to predict properties on the Chemicalize site


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