Multicomponent synthesis and designing of tetrasubstituted imidazole compounds catalyzed via ionic-liquid for acid steel corrosion protection: Experimental exploration and theoretical calculations

doi:10.1016/j.cjche.2022.05.025

Chinese Journal of Chemical Engineering ›› 2023, Vol. 55 ›› Issue (3): 304-319.DOI: 10.1016/j.cjche.2022.05.025

Multicomponent synthesis and designing of tetrasubstituted imidazole compounds catalyzed via ionic-liquid for acid steel corrosion protection: Experimental exploration and theoretical calculations

Hany M. Abd El-Lateef^1,2, Mai M. Khalaf^1,2, K. Shalabi³, Antar A. Abdelhamid^2,4

1. Department of Chemistry, College of Science, King Faisal University, Al-Ahsa 31982, Saudi Arabia;
2. Department of Chemistry, Faculty of Science, Sohag University, Sohag 82524, Egypt;
3. Chemistry Department, Faculty of Science, Mansoura University, Mansoura, Egypt;
4. Chemistry Department, Faculty of Science, Albaha University, Albaha 1988, Saudi Arabia

Received:2021-12-12 Revised:2022-05-17 Online:2023-06-03 Published:2023-03-28
Contact: Hany M. Abd El-Lateef,E-mail:hmahmed@kfu.edu.sa,hany_shubra@science.sohag.edu.eg;K. Shalabi,E-mail:dr-kamal@mans.edu.eg
Supported by:
This work was supported through the Annual Funding track by the Deanship of Scientific Research, Vice Presidency for Graduate Studies and Scientific Research, King Faisal University, Saudi Arabia [GRANT-415].

Multicomponent synthesis and designing of tetrasubstituted imidazole compounds catalyzed via ionic-liquid for acid steel corrosion protection: Experimental exploration and theoretical calculations

Hany M. Abd El-Lateef^1,2, Mai M. Khalaf^1,2, K. Shalabi³, Antar A. Abdelhamid^2,4

1. Department of Chemistry, College of Science, King Faisal University, Al-Ahsa 31982, Saudi Arabia;
2. Department of Chemistry, Faculty of Science, Sohag University, Sohag 82524, Egypt;
3. Chemistry Department, Faculty of Science, Mansoura University, Mansoura, Egypt;
4. Chemistry Department, Faculty of Science, Albaha University, Albaha 1988, Saudi Arabia

通讯作者: Hany M. Abd El-Lateef,E-mail:hmahmed@kfu.edu.sa,hany_shubra@science.sohag.edu.eg;K. Shalabi,E-mail:dr-kamal@mans.edu.eg
基金资助:
This work was supported through the Annual Funding track by the Deanship of Scientific Research, Vice Presidency for Graduate Studies and Scientific Research, King Faisal University, Saudi Arabia [GRANT-415].

Abstract

Abstract: Five new tetrasubstituted imidazoles were designed with outstanding yields (83%-92%) in the occurrence of ionic liquid-based-pyridinium as a catalyst. The constructions of all synthesized derivatives were established by spectral tools and their purities were verified using thin-layer chromatography (TLC), displaying single-spot. The performance of corrosion protection of the prepared imidazole derivatives was examined theoretically and practically for acid steel corrosion. The experimental study was conducted by electrochemical (electrochemical impedance spectroscopy (EIS) and Tafel polarization (PPS)) tools. The findings from the used approaches concluded that the synthesized compounds were well-organized inhibitors with an efficiency of 90.7%-98.5% at 50 ℃ and 0.7 mmol·L^-1. The Tafel polarization results indicate the protective action of the additives was under mixed-monitoring. The additive adsorption on the electrode interface performed as a distinguished aspect for protection. The surface exploration on the blank and protected metal was completed by field emission scanning electron microscopy (FE-SEM). Computational studies by Monte Carlo (MC) simulation and quantum chemical calculation (DFT) were related to practical findings. The corrosion protection adsorption mechanism was reinforced by the preferable fitted Langmuir isotherm model. All findings from the applied-inspected approaches alternately confirm each other.

Key words: Adsorption, Ionic-liquid catalyst, Tetrasubstituted imidazoles, Corrosion, Pickling acid, Mathematical modeling

摘要： Five new tetrasubstituted imidazoles were designed with outstanding yields (83%-92%) in the occurrence of ionic liquid-based-pyridinium as a catalyst. The constructions of all synthesized derivatives were established by spectral tools and their purities were verified using thin-layer chromatography (TLC), displaying single-spot. The performance of corrosion protection of the prepared imidazole derivatives was examined theoretically and practically for acid steel corrosion. The experimental study was conducted by electrochemical (electrochemical impedance spectroscopy (EIS) and Tafel polarization (PPS)) tools. The findings from the used approaches concluded that the synthesized compounds were well-organized inhibitors with an efficiency of 90.7%-98.5% at 50 ℃ and 0.7 mmol·L^-1. The Tafel polarization results indicate the protective action of the additives was under mixed-monitoring. The additive adsorption on the electrode interface performed as a distinguished aspect for protection. The surface exploration on the blank and protected metal was completed by field emission scanning electron microscopy (FE-SEM). Computational studies by Monte Carlo (MC) simulation and quantum chemical calculation (DFT) were related to practical findings. The corrosion protection adsorption mechanism was reinforced by the preferable fitted Langmuir isotherm model. All findings from the applied-inspected approaches alternately confirm each other.

关键词: Adsorption, Ionic-liquid catalyst, Tetrasubstituted imidazoles, Corrosion, Pickling acid, Mathematical modeling

Hany M. Abd El-Lateef, Mai M. Khalaf, K. Shalabi, Antar A. Abdelhamid. Multicomponent synthesis and designing of tetrasubstituted imidazole compounds catalyzed via ionic-liquid for acid steel corrosion protection: Experimental exploration and theoretical calculations[J]. Chinese Journal of Chemical Engineering, 2023, 55(3): 304-319.

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Multicomponent synthesis and designing of tetrasubstituted imidazole compounds catalyzed via ionic-liquid for acid steel corrosion protection: Experimental exploration and theoretical calculations

Multicomponent synthesis and designing of tetrasubstituted imidazole compounds catalyzed via ionic-liquid for acid steel corrosion protection: Experimental exploration and theoretical calculations

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