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Enhanced corrosion inhibition of carbon steel in HCl solution by a new synthesized hydrazone derivative: Mechanism exploration from electrochemical, XPS, and computational studies

机译:通过新的合成的腙衍生物(电化学,XPS和计算研究)的机制探索,增强了HCl溶液中碳钢的腐蚀抑制作用

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摘要

The corrosion inhibition properties of a synthesized hydrazone derivative namely, 1-(4-isopropyl phenyl) -2-(2,4-dinitrophenyl) (HYD (iso)) on API 5L-X60 carbon steel (CS) in 1.0 M HCl solution were evaluated by chemical, electrochemical, X-ray photoelectron spectroscopy (XPS) and theoretical studies. The obtained results revealed that the tested compound acted as a good corrosion inhibitor with inhibition efficiency of 96.32% at a concentration of 5 x 10(-3) M.The polarization technique indicated that the HYD (iso) belonged to mixed-type inhibitors, preventing simultaneously anodic and cathodic reactions. The binding between the HYD (iso)'s molecule and CS surface follows a Langmuir adsorption type model and its inhibition mechanism is assisted by physical and chemical interactions. Scanning electron microscope (SEM) and contact angle analyses were performed to examine the surface morphology of inhibited and uninhibited samples. Additionally, theoretical studies using Density Functional Theory (DFT) and molecular dynamics (MD) simulation were performed to explore the most reactive sites of the hydrazone molecule and its adsorption mechanism. (C) 2020 Published by Elsevier B.V.
机译:合成的腙衍生物的腐蚀抑制性能即1-(4-异丙基)-2-(2,4-二硝基苯)(2,4-二硝基苯)(2,4-二苯基)(2,4-二唑)(2,4-二苯基)(RENM(ISO))在1.0M HCl溶液中的API 5L-X60碳钢(CS)通过化学,电化学,X射线光电子能谱(XPS)和理论研究评估。所得结果表明,经测试的化合物作为良好的腐蚀抑制剂,抑制效率为96.32%,浓度为5×10(-3)M.偏振技术表明HYD(ISO)属于混合型抑制剂,预防同时阳极和阴极反应。 Hyd(ISO)的分子和Cs表面之间的结合遵循Langmuir吸附型模型,其抑制机制通过物理和化学相互作用辅助。进行扫描电子显微镜(SEM)和接触角分析以检查抑制和未抑制样品的表面形态。另外,使用密度官能理论(DFT)和分子动力学(MD)模拟的理论研究以探讨腙分子的最反应性位点及其吸附机制。 (c)2020由elsevier b.v发布。

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