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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Main Authors: Mahboubeh Pishnamazi, Ali Taghvaie Nakhjiri, Arezoo Sodagar Taleghani, Mahdi Ghadiri, Azam Marjani, Saeed Shirazian
Format: Article
Language:English
Published: Public Library of Science (PLoS) 2020-01-01
Series:PLoS ONE
Online Access:https://doi.org/10.1371/journal.pone.0237271
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spelling 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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