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Modeling Transcuticular Uptake from Particle-Based Formulations of Lipophilic Products

[Image: see text] We report a mathematical model for the uptake of lipophilic agrochemicals from dispersed spherical particles within a formulation droplet across the leaf cuticle. Two potential uptake pathways are identified: direct uptake via physical contact between the cuticle and particle and i...

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Autores principales: Elliott, Joseph R., Compton, Richard G.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9214695/
https://www.ncbi.nlm.nih.gov/pubmed/35756577
http://dx.doi.org/10.1021/acsagscitech.2c00029
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author Elliott, Joseph R.
Compton, Richard G.
author_facet Elliott, Joseph R.
Compton, Richard G.
author_sort Elliott, Joseph R.
collection PubMed
description [Image: see text] We report a mathematical model for the uptake of lipophilic agrochemicals from dispersed spherical particles within a formulation droplet across the leaf cuticle. Two potential uptake pathways are identified: direct uptake via physical contact between the cuticle and particle and indirect uptake via initial release of material into the formulation droplet followed by partition across the cuticle-formulation interface. Numerical simulation is performed to investigate the relevance of the particle-cuticle contact angle, the release kinetics of the particle, and the particle size relative to the cuticle thickness. Limiting cases for each pathway are identified and investigated. The input of typical physicochemical parameters suggests that the indirect pathway is generally dominant unless pesticide release is under strict kinetic control. Evidence is presented for a hitherto unrecognized “leaching effect” and the mutual exclusivity of the two pathways.
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spelling pubmed-92146952022-06-23 Modeling Transcuticular Uptake from Particle-Based Formulations of Lipophilic Products Elliott, Joseph R. Compton, Richard G. ACS Agric Sci Technol [Image: see text] We report a mathematical model for the uptake of lipophilic agrochemicals from dispersed spherical particles within a formulation droplet across the leaf cuticle. Two potential uptake pathways are identified: direct uptake via physical contact between the cuticle and particle and indirect uptake via initial release of material into the formulation droplet followed by partition across the cuticle-formulation interface. Numerical simulation is performed to investigate the relevance of the particle-cuticle contact angle, the release kinetics of the particle, and the particle size relative to the cuticle thickness. Limiting cases for each pathway are identified and investigated. The input of typical physicochemical parameters suggests that the indirect pathway is generally dominant unless pesticide release is under strict kinetic control. Evidence is presented for a hitherto unrecognized “leaching effect” and the mutual exclusivity of the two pathways. American Chemical Society 2022-04-28 2022-06-20 /pmc/articles/PMC9214695/ /pubmed/35756577 http://dx.doi.org/10.1021/acsagscitech.2c00029 Text en © 2022 The Authors. Published by American Chemical Society https://creativecommons.org/licenses/by/4.0/Permits the broadest form of re-use including for commercial purposes, provided that author attribution and integrity are maintained (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Elliott, Joseph R.
Compton, Richard G.
Modeling Transcuticular Uptake from Particle-Based Formulations of Lipophilic Products
title Modeling Transcuticular Uptake from Particle-Based Formulations of Lipophilic Products
title_full Modeling Transcuticular Uptake from Particle-Based Formulations of Lipophilic Products
title_fullStr Modeling Transcuticular Uptake from Particle-Based Formulations of Lipophilic Products
title_full_unstemmed Modeling Transcuticular Uptake from Particle-Based Formulations of Lipophilic Products
title_short Modeling Transcuticular Uptake from Particle-Based Formulations of Lipophilic Products
title_sort modeling transcuticular uptake from particle-based formulations of lipophilic products
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9214695/
https://www.ncbi.nlm.nih.gov/pubmed/35756577
http://dx.doi.org/10.1021/acsagscitech.2c00029
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