TY - JOUR
T1 - Partition coefficients of furan derivative compounds in 1-n-butyl-3-methylimidazolium chloride ([bmim][Cl])-supercritical CO2 biphasic systems and their correlation and prediction with the LSER-δ model
AU - Hiraga, Yuya
AU - Hayasaka, Atsushi
AU - Sato, Yoshiyuki
AU - Watanabe, Masaru
AU - Smith, Richard L.
PY - 2013
Y1 - 2013
N2 - Infinite dilution partition coefficients of furan and furan derivative compounds (2-methylfuran, 2-ethylfuran, furfural and furfuryl alcohol) between ionic liquid ([bmim][Cl]: 1-n-butyl-3-methylimidazolium chloride) and supercritical carbon dioxide (scCO2) were measured at temperatures from 313 to 353K and at pressures from 9 to 21MPa with a chromatographic method. A linear solvation energy relationship-solubility parameter (LSER-δ) model was applied to available data and was compared with a proposed entropic term and with the Sanchez-Lacombe equation of state (SL EoS). The average relative deviations (ARDs) of furan derivative compounds, which were newly measured, for SL EoS model, LSER-δ model and modified LSER-δ model were within 3.2%, 14.9% and 14.7%, respectively. The LSER-δ model can be applied as prediction model for K∞w3 of ionic liquid-CO2 systems for which solute descriptors are available.
AB - Infinite dilution partition coefficients of furan and furan derivative compounds (2-methylfuran, 2-ethylfuran, furfural and furfuryl alcohol) between ionic liquid ([bmim][Cl]: 1-n-butyl-3-methylimidazolium chloride) and supercritical carbon dioxide (scCO2) were measured at temperatures from 313 to 353K and at pressures from 9 to 21MPa with a chromatographic method. A linear solvation energy relationship-solubility parameter (LSER-δ) model was applied to available data and was compared with a proposed entropic term and with the Sanchez-Lacombe equation of state (SL EoS). The average relative deviations (ARDs) of furan derivative compounds, which were newly measured, for SL EoS model, LSER-δ model and modified LSER-δ model were within 3.2%, 14.9% and 14.7%, respectively. The LSER-δ model can be applied as prediction model for K∞w3 of ionic liquid-CO2 systems for which solute descriptors are available.
KW - Equation of state
KW - Ionic liquid
KW - Linear solvation energy relationship
KW - Supercritical fluids chromatography
UR - http://www.scopus.com/inward/record.url?scp=84883657664&partnerID=8YFLogxK
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U2 - 10.1016/j.supflu.2012.11.010
DO - 10.1016/j.supflu.2012.11.010
M3 - Article
AN - SCOPUS:84883657664
SN - 0896-8446
VL - 79
SP - 32
EP - 40
JO - Journal of Supercritical Fluids
JF - Journal of Supercritical Fluids
ER -