Jh. Park et al., UNIFAC MODEL AS A HEURISTIC GUIDE FOR ESTIMATING RETENTION IN REVERSED-PHASE LIQUID-CHROMATOGRAPHY, Journal of chromatography, 656(1-2), 1993, pp. 69-79
The utility of the UNIFAC activity coefficient determination method fo
r understanding the magnitude of solute-solvent interactions in revers
ed-phase liquid chromatography (RPLC) is discussed. UNIFAC-computed pa
rtition coefficients for the transfer of various homologous series of
solutes from aqueous mixtures of methanol, acetonitrile and tetrahydro
furan to hexadecane, octane, butane and benzene were used to investiga
te the effects of the carbon number, the type of functional group of t
he solutes, the composition of the mobile phases, the chain length of
alkyl-bonded stationary phases and temperature on retention in reverse
d-phase liquid-liquid partition chromatography. Although UNIFAC is not
accurate enough to be useful for the quantitative determination of re
tention in RPLC, it is useful in explaining a wide variety of issues o
f general importance in RPLC.