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胶束电动色谱和微乳液电动色谱中二取代苯保留的比较和预测。

Comparison and prediction of the retention in micellar electrokinetic chromatography and microemulsion electrokinetic chromatography for disubstituted benzenes.

机构信息

Chromatography and Separation Research Unit, Department of Chemistry, Faculty of Science, Chulalongkorn University, Bangkok 10330, Thailand.

出版信息

Electrophoresis. 2010 Jan;31(4):695-701. doi: 10.1002/elps.200900486.

DOI:10.1002/elps.200900486
PMID:20162592
Abstract

Retention index (I), rather than retention factor (k), was found to be a more reasonable parameter for comparison of the relative affinity of disubstituted benzenes in MEEKC and MEKC, due to independent of I with the SDS surfactant concentration. MEKC and MEEKC may give similar or different I values, depending on types of moieties. With known I and K(ow) for alkylbenzenes as references in MEKC and MEEKC, the values of K(ow) for disubstituted benzenes can be estimated from the observed I values, where K(ow) is the octanol-water distribution constant. In addition, a group additive approach can be used to predict I for disubstituted benzenes with different moieties from the average observed I for the disubstituted benzenes with same moieties. However, electronic effects and/or intramolecular interaction may result in the different observed I from prediction.

摘要

保留指数(I)而非保留因子(k)被发现是比较 MEKC 和 MEEKC 中二取代苯相对亲合力的更合理参数,因为 I 独立于 SDS 表面活性剂浓度。MEKC 和 MEEKC 可能给出相似或不同的 I 值,这取决于取代基的类型。在 MEKC 和 MEEKC 中,以烷基苯的已知 I 和 Kow 作为参考,可根据观察到的 I 值估算二取代苯的 Kow 值,其中 Kow 是辛醇-水分配常数。此外,可使用基团加和法,根据具有相同取代基的二取代苯的平均观察到的 I 值,预测具有不同取代基的二取代苯的 I 值。然而,电子效应和/或分子内相互作用可能导致观察到的 I 值与预测值不同。

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