Theoretical Study to Evaluate Experimental Corrosion Inhibition of Ammonium Salt Derivatives for Mild Steel in Acidic Solution

IF 1.1 4区 材料科学 Q3 METALLURGY & METALLURGICAL ENGINEERING Protection of Metals and Physical Chemistry of Surfaces Pub Date : 2024-10-25 DOI:10.1134/S2070205124701673
Mehdi Salih Shihab, Nasreen Raheem Jber, Mariam Sadoon Mohsin
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Abstract

Some new organic triethylammonium salts, with names: triethylammonium 4-((4-(aminomethyl)phenyl)amino)-4-oxobut-2-enoate (B4); triethylammonium5-((4-(aminomethyl)phenyl)amino)-5-oxopentanoate (B5); and triethylammonium 4-((4-(aminomethyl)phenyl)amino)-4-oxobutanoate (B6) were synthesized and identified successfully. They were applied as corrosion organic inhibitors for mild steel in acidic environment. The new organic triethylammonium salts were tested in 1M sulfuric acid for 24 h at room temperature by applying the weight loss measurements. The high efficiency of inhibition values of all triethylammonium salts (B4, B5 & B6) were revealed at the maximum organic triethylammonium salts concentrations. The decreasing of corrosion rates of mild steel were associated with increasing the concentration of organic inhibitors (B4-B6), as well as, the increasing with coverage surface degree. The adsorption free energy values were explained the effects of physisorption for organic salts (B4, B5, and B6). The correlation between experimental results and theoretical data was considered via semi-empirical molecular orbital calculations for the three studied inhibitors. Theoretical calculations were used to understand the nature of interaction among organic corrosion inhibitor molecules and the metal surface of the mild steel.

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评估铵盐衍生物在酸性溶液中对低碳钢腐蚀抑制实验的理论研究
一些新的有机三乙基铵盐,名称如下成功合成并鉴定了 4-((4-(氨基甲基)苯基)氨基)-4-氧代丁-2-烯酸三乙基铵(B4)、5-((4-(氨基甲基)苯基)氨基)-5-氧代戊酸三乙基铵(B5)和 4-((4-(氨基甲基)苯基)氨基)-4-氧代丁酸三乙基铵(B6)。它们被用作酸性环境中低碳钢的有机缓蚀剂。室温下,在 1M 硫酸中对新型有机三乙基铵盐进行了 24 小时的失重测试。在最大有机三乙基铵盐浓度下,所有三乙基铵盐(B4、B5 & B6)的抑制效率值都很高。低碳钢的腐蚀速率随着有机抑制剂(B4-B6)浓度的增加而降低,同时也随着表面覆盖度的增加而增加。有机盐(B4、B5 和 B6)的吸附自由能值解释了物理吸附的影响。通过对所研究的三种抑制剂进行半经验分子轨道计算,考虑了实验结果与理论数据之间的相关性。理论计算用于了解有机缓蚀剂分子与低碳钢金属表面之间相互作用的性质。
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来源期刊
CiteScore
1.90
自引率
18.20%
发文量
90
审稿时长
4-8 weeks
期刊介绍: Protection of Metals and Physical Chemistry of Surfaces is an international peer reviewed journal that publishes articles covering all aspects of the physical chemistry of materials and interfaces in various environments. The journal covers all related problems of modern physical chemistry and materials science, including: physicochemical processes at interfaces; adsorption phenomena; complexing from molecular and supramolecular structures at the interfaces to new substances, materials and coatings; nanoscale and nanostructured materials and coatings, composed and dispersed materials; physicochemical problems of corrosion, degradation and protection; investigation methods for surface and interface systems, processes, structures, materials and coatings. No principe restrictions exist related systems, types of processes, methods of control and study. The journal welcomes conceptual, theoretical, experimental, methodological, instrumental, environmental, and all other possible studies.
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