ChemSpider 2D Image | (3beta,5alpha,14xi)-4,4-Dimethylcholest-8-en-3-ol | C29H50O

(3β,5α,14ξ)-4,4-Dimethylcholest-8-en-3-ol

  • Molecular FormulaC29H50O
  • Average mass414.707 Da
  • Monoisotopic mass414.386169 Da
  • ChemSpider ID30792004

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(3β,5α,14ξ)-4,4-Dimethylcholest-8-en-3-ol [German] [ACD/IUPAC Name]
(3β,5α,14ξ)-4,4-Dimethylcholest-8-en-3-ol [ACD/IUPAC Name]
(3β,5α,14ξ)-4,4-Diméthylcholest-8-én-3-ol [French] [ACD/IUPAC Name]
Cholest-8-en-3-ol, 4,4-dimethyl-, (3β,5α,14ξ)- [ACD/Index Name]
(2S,5S,7R,14R,15R)-2,6,6,15-tetramethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.02,7.011,15]heptadec-1(10)-en-5-ol
3β-hydroxy-4,4-dimethyl-8(9)-cholestene
3β-hydroxy-4,4-dimethylcholest-8(9)-ene
4,4-dimethyl-3β-hydroxy-8(9)-cholestene
4,4-dimethyl-3β-hydroxycholest-8(9)-ene
4,4-Dimethyl-5a-cholesta-8-en-3b-ol
More...

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

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

Density: 1.0±0.1 g/cm3
Boiling Point: 492.9±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.5±6.0 kJ/mol
Flash Point: 217.8±20.7 °C
Index of Refraction: 1.522
Molar Refractivity: 129.0±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 10.83
ACD/LogD (pH 5.5): 9.67
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 4352580.00
ACD/LogD (pH 7.4): 9.67
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 4352580.00
Polar Surface Area: 20 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 37.5±5.0 dyne/cm
Molar Volume: 423.4±5.0 cm3

Click to predict properties on the Chemicalize site


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