Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
1248864 | TrAC Trends in Analytical Chemistry | 2006 | 11 Pages |
Abstract
Soil-sorption coefficient (KOC) assessment is essential before placing a new chemical substance on the market.Since experimental KOC measurements are tedious, time-consuming and costly, alternative approaches to estimating KOC from other descriptors have been proposed. We review the use of chromatographic retention (log k) values, obtained in different types of chromatographic systems, as descriptors to establish predictive log KOC-log k models.We highlighted critical aspects of such models and performed a comparative study using data in the literature. We compare two strategies to deal with the large variability of experimental log KOC data. We contrast the results of this study with the main conclusions reported in the literature.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Analytical Chemistry
Authors
José María Bermúdez-Saldaña, Laura Escuder-Gilabert, María José Medina-Hernández, Rosa María Villanueva-Camañas, Salvador Sagrado,