Song, Zhen; Zhou, Teng; Qi, Zhiwen; Sundmacher, Kai published the artcile< Computer-aided screening of deep eutectic solvent systems for the associative extraction of α-tocopherol from deodorizer distillate>, Application In Synthesis of 112-63-0, the main research area is tocopherol deodorizer distillate eutectic solvent system extraction.
This work presents a computer-aided framework for the screening of deep eutectic solvent (DES) systems by using the α-tocopherol extraction from methylated oil deodorizer distillates (MODD) as an example of practical relevance. Taking advantage of the differences in the hydrogen bond donating abilities of α-tocopherol and methyllinoleate (model compounds in MODD), the DES screening task is to select suitable components that can achieve the associative extraction of α-tocopherol by in situ DES formation at high selectivity against methyllinoleate. The COSMO-RS model is employed in the DES screening for two purposes: (1) The solid-liquid equilibrium between α-tocopherol and each candidate component are calculated to check the potential for DES formation and identify the existence of a proper liquid window. (2) The infinite dilution capacity and selectivity of different components for the α-tocopherol/methyllinoleate extraction are predicted to estimate their potential for the separation task. The components preselected by COSMO-RS evaluation are further examined regarding other phys. as well as environmental, health, and safety (EHS) properties.
Computer-Aided Chemical Engineering published new progress about Deep eutectic solvents. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Application In Synthesis of 112-63-0.
Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics