Molecular separation of ibuprofen and 4-isobutylacetophenone using octanol organic solution by porous polymeric membranes.
Molecular separation of pharmaceutical contaminants from water has been recently of great interest to alleviate their detrimental impacts on environment and human well-being. As the novelty, this investigation aims to develop a mechanistic modeling approach and consequently its related CFD-based sim...
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doaj-7c147eedb48548e294c238a14ecf168f2021-03-03T21:59:40ZengPublic Library of Science (PLoS)PLoS ONE1932-62032020-01-01158e023727110.1371/journal.pone.0237271Molecular separation of ibuprofen and 4-isobutylacetophenone using octanol organic solution by porous polymeric membranes.Mahboubeh PishnamaziAli Taghvaie NakhjiriArezoo Sodagar TaleghaniMahdi GhadiriAzam MarjaniSaeed ShirazianMolecular separation of pharmaceutical contaminants from water has been recently of great interest to alleviate their detrimental impacts on environment and human well-being. As the novelty, this investigation aims to develop a mechanistic modeling approach and consequently its related CFD-based simulations to evaluate the molecular separation efficiency of ibuprofen (IP) and its metabolite 4-isobutylacetophenone (4-IBAP) from water inside a porous membrane contactor (PMC). For this purpose, octanol has been applied as an organic phase to extract IP and 4-IBAP from the aqueous solution due to high solubility of solutes in octanol. Finite element (FE) technique is used as a promising tool to simultaneously solve continuity and Navier-Stokes equations and their associated boundary conditions in tube, shell and porous membrane compartments of the PMC. The results demonstrated that the application of PMC and liquid-liquid extraction process can be significantly effective due to separating 51 and 54% of inlet IP and 4-IBAP molecules from aqueous solution, respectively. Moreover, the impact of various operational / functional parameters such as packing density, the number of fibrous membrane, the module length, the membrane porosity / tortuosity, and ultimately the aqueous solution flow rate on the molecular separation efficiency of IP and 4-IBAP is studied in more details.https://doi.org/10.1371/journal.pone.0237271 |
collection |
DOAJ |
language |
English |
format |
Article |
sources |
DOAJ |
author |
Mahboubeh Pishnamazi Ali Taghvaie Nakhjiri Arezoo Sodagar Taleghani Mahdi Ghadiri Azam Marjani Saeed Shirazian |
spellingShingle |
Mahboubeh Pishnamazi Ali Taghvaie Nakhjiri Arezoo Sodagar Taleghani Mahdi Ghadiri Azam Marjani Saeed Shirazian Molecular separation of ibuprofen and 4-isobutylacetophenone using octanol organic solution by porous polymeric membranes. PLoS ONE |
author_facet |
Mahboubeh Pishnamazi Ali Taghvaie Nakhjiri Arezoo Sodagar Taleghani Mahdi Ghadiri Azam Marjani Saeed Shirazian |
author_sort |
Mahboubeh Pishnamazi |
title |
Molecular separation of ibuprofen and 4-isobutylacetophenone using octanol organic solution by porous polymeric membranes. |
title_short |
Molecular separation of ibuprofen and 4-isobutylacetophenone using octanol organic solution by porous polymeric membranes. |
title_full |
Molecular separation of ibuprofen and 4-isobutylacetophenone using octanol organic solution by porous polymeric membranes. |
title_fullStr |
Molecular separation of ibuprofen and 4-isobutylacetophenone using octanol organic solution by porous polymeric membranes. |
title_full_unstemmed |
Molecular separation of ibuprofen and 4-isobutylacetophenone using octanol organic solution by porous polymeric membranes. |
title_sort |
molecular separation of ibuprofen and 4-isobutylacetophenone using octanol organic solution by porous polymeric membranes. |
publisher |
Public Library of Science (PLoS) |
series |
PLoS ONE |
issn |
1932-6203 |
publishDate |
2020-01-01 |
description |
Molecular separation of pharmaceutical contaminants from water has been recently of great interest to alleviate their detrimental impacts on environment and human well-being. As the novelty, this investigation aims to develop a mechanistic modeling approach and consequently its related CFD-based simulations to evaluate the molecular separation efficiency of ibuprofen (IP) and its metabolite 4-isobutylacetophenone (4-IBAP) from water inside a porous membrane contactor (PMC). For this purpose, octanol has been applied as an organic phase to extract IP and 4-IBAP from the aqueous solution due to high solubility of solutes in octanol. Finite element (FE) technique is used as a promising tool to simultaneously solve continuity and Navier-Stokes equations and their associated boundary conditions in tube, shell and porous membrane compartments of the PMC. The results demonstrated that the application of PMC and liquid-liquid extraction process can be significantly effective due to separating 51 and 54% of inlet IP and 4-IBAP molecules from aqueous solution, respectively. Moreover, the impact of various operational / functional parameters such as packing density, the number of fibrous membrane, the module length, the membrane porosity / tortuosity, and ultimately the aqueous solution flow rate on the molecular separation efficiency of IP and 4-IBAP is studied in more details. |
url |
https://doi.org/10.1371/journal.pone.0237271 |
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