ChemSpider 2D Image | (3beta,5alpha,9xi,17xi)-Cholest-8(14)-en-3-ol | C27H46O

(3β,5α,9ξ,17ξ)-Cholest-8(14)-en-3-ol

  • Molecular FormulaC27H46O
  • Average mass386.654 Da
  • Monoisotopic mass386.354858 Da
  • ChemSpider ID59696335

  • defined stereocentres - 5 of 7 defined stereocentres

More details:

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

(3β,5α,9ξ,17ξ)-Cholest-8(14)-en-3-ol [German] [ACD/IUPAC Name]
(3β,5α,9ξ,17ξ)-Cholest-8(14)-en-3-ol [ACD/IUPAC Name]
(3β,5α,9ξ,17ξ)-Cholest-8(14)-én-3-ol [French] [ACD/IUPAC Name]
Cholest-8(14)-en-3-ol, (3β,5α,9ξ,17ξ)- [ACD/Index Name]
(2S,5S,7S,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.02,7.011,15]heptadec-10-en-5-ol
5α-Cholest-8(14)-en-3β-ol

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

Density: 1.0±0.1 g/cm3
Boiling Point: 480.1±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.8±6.0 kJ/mol
Flash Point: 209.1±20.7 °C
Index of Refraction: 1.525
Molar Refractivity: 119.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 9.80
ACD/LogD (pH 5.5): 8.77
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1404807.63
ACD/LogD (pH 7.4): 8.77
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1404807.63
Polar Surface Area: 20 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 38.2±5.0 dyne/cm
Molar Volume: 390.7±5.0 cm3

Click to predict properties on the Chemicalize site


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