二溴水杨醛.pdf

3,5-二溴水杨醛-2-噻吩甲酰肼席夫碱缓蚀剂在油田水中对碳 钢的缓蚀性能及分子动力学模拟 1,2 1* 1 1 刘洁 刘峥 刘进 谢思维 1.桂林理工大学化学与生物工程系，桂林 541004 2. 中国石油化工股份有限公司茂名分公司炼油分部，茂名 525011 摘要：合成了一种新的席夫碱缓蚀剂3,5-二溴水杨醛-2-噻吩甲酰肼（L2 ），通过 Tefel 极化曲线、电化学阻抗、扫描电镜和分子动力学模拟方法研究了该缓蚀剂 在模拟油田水中对碳钢的缓蚀效果，并探讨了其缓蚀机理和吸附行为。结果表明， - L2 在不同温度、H S 浓度、pH 值和 Cl 浓度条件下的模拟油田水中对碳钢均具 2 有良好的缓蚀性能。分子动力学模拟结果表明，在水溶液中缓蚀剂L2 分子可以 稳定地平行吸附在金属表面，有效地将金属表面和水分子隔开，从而起到缓蚀作 用，吸附方式为多位点化学吸附；同时L2 形成的分子吸附膜可有效地抑制腐蚀 - + 离子（Cl 和H O ）在吸附膜中的扩散，避免了金属表面与腐蚀介质接触而发生 3 腐蚀，从而表现出良好的缓蚀性能。 关键词：席夫碱；缓蚀性能；碳钢；模拟油田水；分子动力学模拟 Inhibition Properties and Molecular Dynamics Simulation Study of 3,5 - dibromosalicylaldehyde-2-thenoyl Hydrazine Schiff Base for Carbon Steel in Oilfield Water 1,2 1* 1 1 (LIU Jie LIU Zheng LIU Jin XIE Si-wei ) 1.College of Chemical and Biological Engineering Guilin University of Technology, Guilin 541004, China； 2.Sinopec maoming company，Maoming 525011，China Abstract:3,5-dibromosalicylaldehyde-2-thenoyl hydrazine Schiff base compounds （L2 ） was synthesized. Its inhibition properties and adsorption behavior for carbon steel in simulative oilfield water were investigated by electrochemical methods, scanning electron microscopy and molecular dynamics simulations, respectively. Experiment results indicated that L2 has excellent corrosion inhibition performance for carbon steel in simulative oilfield water, and also has great Inhibition capacity for carbon steel in simulative oilfield water with various concentrations of pH and temperature. The molecular dynamics simulation results proved that L2 molecules 基金项目：国家自然科学基金资助项目）和广西