Mohammed Mustafa Yousif Modwi, Huixia Feng, Yafei Liu, Zhao juanjuan
{"title":"壳聚糖希夫碱衍生物作为Q235碳钢的环保型缓蚀剂的实验与理论结合研究","authors":"Mohammed Mustafa Yousif Modwi, Huixia Feng, Yafei Liu, Zhao juanjuan","doi":"10.1016/j.jpcs.2025.113205","DOIUrl":null,"url":null,"abstract":"<div><div>In this study, two novel chitosan-based Schiff bases, SCBS-I and SCBS-II, were synthesized by condensation reactions between chitosan and isatin or menthone, respectively. The prepared Schiff bases were further quaternized via 2,3-epoxypropyltrimethylammonium chloride (EPTAC) to augment inhibitor solubility and inhibition efficiency. Developed as a green and eco-friendly corrosion inhibitor for Q235 carbon steel in hydrochloric solution. The successful synthesis of two chitosan derivatives was characterized via <sup>1</sup>H NMR and FTIR studies. The inhibitors efficiency was evaluated through weight loss, with a greater inhibition efficiency of 94.8 % achieved at 250 mg. L<sup>−1</sup>. Electrochemical studies including EIS and PDP measurements suggest the inhibitors act as mixed types, while aligning with the Langmuir adsorption isotherms model. Gibbs free energies (ΔG) indicate that the inhibitors adsorb onto the carbon steel surface via physical and chemical adsorptions. The surface morphology was investigated using SEM, and XPS confirmed the formation of an adsorbed protective film on the metal surface. Molecular dynamics simulations were applied to investigate the corrosion inhibition mechanism. These findings provide new insights into the design of eco-friendly Schiff base–chitosan derivatives, and future work will focus on optimizing molecular structures and evaluating their performance in more complex corrosive environments.</div></div>","PeriodicalId":16811,"journal":{"name":"Journal of Physics and Chemistry of Solids","volume":"208 ","pages":"Article 113205"},"PeriodicalIF":4.9000,"publicationDate":"2025-09-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"A novel chitosan Schiff base derivatives as eco-friendly corrosion inhibitors for Q235 carbon Steel: A combined experimental and theoretical study\",\"authors\":\"Mohammed Mustafa Yousif Modwi, Huixia Feng, Yafei Liu, Zhao juanjuan\",\"doi\":\"10.1016/j.jpcs.2025.113205\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>In this study, two novel chitosan-based Schiff bases, SCBS-I and SCBS-II, were synthesized by condensation reactions between chitosan and isatin or menthone, respectively. The prepared Schiff bases were further quaternized via 2,3-epoxypropyltrimethylammonium chloride (EPTAC) to augment inhibitor solubility and inhibition efficiency. Developed as a green and eco-friendly corrosion inhibitor for Q235 carbon steel in hydrochloric solution. The successful synthesis of two chitosan derivatives was characterized via <sup>1</sup>H NMR and FTIR studies. The inhibitors efficiency was evaluated through weight loss, with a greater inhibition efficiency of 94.8 % achieved at 250 mg. L<sup>−1</sup>. Electrochemical studies including EIS and PDP measurements suggest the inhibitors act as mixed types, while aligning with the Langmuir adsorption isotherms model. Gibbs free energies (ΔG) indicate that the inhibitors adsorb onto the carbon steel surface via physical and chemical adsorptions. The surface morphology was investigated using SEM, and XPS confirmed the formation of an adsorbed protective film on the metal surface. Molecular dynamics simulations were applied to investigate the corrosion inhibition mechanism. These findings provide new insights into the design of eco-friendly Schiff base–chitosan derivatives, and future work will focus on optimizing molecular structures and evaluating their performance in more complex corrosive environments.</div></div>\",\"PeriodicalId\":16811,\"journal\":{\"name\":\"Journal of Physics and Chemistry of Solids\",\"volume\":\"208 \",\"pages\":\"Article 113205\"},\"PeriodicalIF\":4.9000,\"publicationDate\":\"2025-09-14\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Physics and Chemistry of Solids\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0022369725006584\",\"RegionNum\":3,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Physics and Chemistry of Solids","FirstCategoryId":"88","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0022369725006584","RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
A novel chitosan Schiff base derivatives as eco-friendly corrosion inhibitors for Q235 carbon Steel: A combined experimental and theoretical study
In this study, two novel chitosan-based Schiff bases, SCBS-I and SCBS-II, were synthesized by condensation reactions between chitosan and isatin or menthone, respectively. The prepared Schiff bases were further quaternized via 2,3-epoxypropyltrimethylammonium chloride (EPTAC) to augment inhibitor solubility and inhibition efficiency. Developed as a green and eco-friendly corrosion inhibitor for Q235 carbon steel in hydrochloric solution. The successful synthesis of two chitosan derivatives was characterized via 1H NMR and FTIR studies. The inhibitors efficiency was evaluated through weight loss, with a greater inhibition efficiency of 94.8 % achieved at 250 mg. L−1. Electrochemical studies including EIS and PDP measurements suggest the inhibitors act as mixed types, while aligning with the Langmuir adsorption isotherms model. Gibbs free energies (ΔG) indicate that the inhibitors adsorb onto the carbon steel surface via physical and chemical adsorptions. The surface morphology was investigated using SEM, and XPS confirmed the formation of an adsorbed protective film on the metal surface. Molecular dynamics simulations were applied to investigate the corrosion inhibition mechanism. These findings provide new insights into the design of eco-friendly Schiff base–chitosan derivatives, and future work will focus on optimizing molecular structures and evaluating their performance in more complex corrosive environments.
期刊介绍:
The Journal of Physics and Chemistry of Solids is a well-established international medium for publication of archival research in condensed matter and materials sciences. Areas of interest broadly include experimental and theoretical research on electronic, magnetic, spectroscopic and structural properties as well as the statistical mechanics and thermodynamics of materials. The focus is on gaining physical and chemical insight into the properties and potential applications of condensed matter systems.
Within the broad scope of the journal, beyond regular contributions, the editors have identified submissions in the following areas of physics and chemistry of solids to be of special current interest to the journal:
Low-dimensional systems
Exotic states of quantum electron matter including topological phases
Energy conversion and storage
Interfaces, nanoparticles and catalysts.