Diffusion of Squalene in Nonaqueous Solvents.

Abstract

Capillary flow techniques have been used to determine the translational diffusion constant, D, of squalene in seven alkanes and five cyclohexanes. The alkanes are n-hexane, n-octane, n-decane, n-dodecane, n-tetradecane, 2,2,4,4,6,8,8-heptamethylnonane (isocetane), and 2,6,10,14-tetramethylpentadecane (pristane). The cyclohexanes are cyclohexane, n-butylcyclohexane, n-hexylcyclohexane, n-octylcyclohexane, and n-dodecylcyclohexane. When combined with published data in CD2Cl2, ethyl acetate, n-hexadecane, squalane, n-octane–squalane mixtures, and supercritical CO2, the 35 diffusion constants and viscosities, η, vary by factors of ∼230 and ∼500, respectively. A fit to the modified Stokes–Einstein equation (MSE, D/T = ASE/ηp) gives an average absolute percentage difference (AAPD) of 7.72% between the experimental and calculated D values where p and ASE are constants, T is the absolute temperature, and the AAPD is the average value of (102) (|Dcalcd – Dexptl|/Dexptl). Two other MSE fits using subsets of the 35 diffusion constants may be useful for (a) estimating the viscosity of the hydrophobic core of lipid droplets, where squalene is a naturally occurring component, and (b) providing estimates of the D values needed to design extraction processes by which squalene is obtained from plant oils. The Wilke–Chang equation also was considered and found to give larger AAPDs than the corresponding MSE fits.