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Screening of Double Solvents Based on Multi-Index Evaluation Method for the Selective Separation -Cresol from Model Oil


AUTHORS

Liu Q , Zhang X , . ACS omega. 2022 7 11; 7(29). 25798-25810

ABSTRACT

Ionic liquid (IL) as an extractant is an effective method for separating oil-phenol mixtures. However, relatively high neutral oil entrainment can lead to oil loss and a remarkable reduction in phenol purity. To reduce the entrainment of neutral oil in the extraction process, a double-solvent extraction system composed of IL 1-ethyl-3-methyl imidazolium acetate ([Cmim][Ac]) and an organic solvent was investigated. The multi-index evaluation method was used to screen the conventional organic solvent. The double-solvent extraction experiments were employed to verify the accuracy of the COSMO-RS prediction. Eighteen organic solvents, the interaction energy with -cresol and cumene (neutral oil), their extraction ability, and mutual solubility with [Cmim][Ac], were calculated by COSMO-RS. Alkane and cycloalkane were screened due to their strong interaction and low distribution coefficient with cumene, as well as the low mutual solubility with [Cmim][Ac]. The experimental results were in good agreement with the COSMO-RS prediction, and cyclopentane as an organic solvent had the lowest distribution coefficient and entrainment of cumene because of its strong nonpolarity and hydrogen-bond repulsive interaction, which was explained by the σ-profile and σ-potential analysis. When the cyclopentane-to-[Cmim][Ac] mass ratio increased from 0.0 to 3.0, the entrainment of cumene was evidently declined from 39.5 to 5.8% and the selectivity to -cresol was improved from 378.0 to 1058.5.



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