Remediation of efavirenz using a magnetic molecularly imprinted titania nanocomposite
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Abstract
In the current study, remediation of efavirenz as a model antiretroviral drug in wastewater
effluents was investigated using a hybrid photodegrader based on titania embed on a magnetic
molecularly imprinted polymer (MMIP). Initially, a MMIP was synthesized to specifically
recognize and remove efavirenz from wastewater effluents. The magnetic smart polymer was
synthesized via a bulk polymerization technique with efavirenz as the template, and p-vinyl
benzoic acid the functional monomer in the presence of magnetite nanoparticles. The MMIP
was characterized using Fourier transform infrared spectroscopy and thermogravimetric
analysis. The performance of MMIP was optimized using a central composite design. The
optimum conditions for effective adsorption of efavirenz were pH 6.5, MMIP mass of 15 mg,
1 mg L-1
efavirenz concentration and contact time of 40 min. The optimal binding capacity
achieved after 40 min of contact time and neutral conditions was 44.9 µg g-1
.
Batch studies revealed that pseudo-second order and the Langmuir isotherm were the models
that explained the kinetics and mechanism of adsorption of efavirenz onto the MMIP. This
suggested that the interaction between the MMIP and the efavirenz was through chemisorption
and that once efavirenz binding reaches a maximum limit, no more binding occurs. The MMIP
was finally applied in the removal of efavirenz from real wastewater effluents polluted with
3.99 ng mL-1
of efavirenz. The polymeric sorbent could achieve 44.8% removal efficiencies.
Reusability studies showed less than 4% average loss in the binding capacity with every reuse
cycle, while there was no loss in binding capabilities when the polymer was utilized at about
half its binding capacity.
Finally, photocatalytic degradation of efavirenz was investigated as a potential remedial tool
for efavirenz in wastewater effluents. Titania was imbedded onto the MMIP to form a hybrid
MMIP/TiO2 nanocomposite with the ability to trap efavirenz from wastewater followed by its
vii
photodegradation. Its performance was also investigated using factorial design involving
initial concentration of efavirenz (20 - 60 µg L-1
), mass of the MMIP/TiO2 (5 -15 mg) and the
time of irradiation (20 - 40 min). The results were also observed in a form of contour plots. Up
to 99% photodegradation of efavirenz was achieved within 15 min. However, it was observed
that the photodegrader performed better under higher concentrations of efavirenz
concentrations. In general, the synthesis and optimization of a hybrid molecularly imprinted
titania nanocomposite for photodegradation of efavirenz in wastewater effluents was
successful. Its performance has proven that it can be a viable tool for remediation of efavirenz
in wastewater effluents. Efavirenz cannot be removed by conventional wastewater treatment
processes and advanced technologies such as the MMIP/TiO2 nanocomposite synthesized in
the current study could help minimize the release of efavirenz into surface water systems. This
work has yielded three manuscripts; a review article and two research papers. The review has
been published, one manuscript is under review and the final one has been drafted.
Description
A dissertation submitted to the School of Science and Technology, Durban University of Technology Sciences University in fulfilment of the requirements for the degree of Master of Applied Science in Chemistry, Durban University of Technology, Durban, South Africa, 2025.
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DOI
https://doi.org/10.51415/10321/6236
