Hicham Zgueni , Mohammed El Mesky , Rahime Eshaghi Malekshah , Fatima Ennafaa , Mohamed Znini , El Houssine Mabrouk , Driss Chebabe
{"title":"基于酚醛的新型双链表面活性剂的合成、结构表征及对碳钢在1 M HCl中腐蚀的抑制作用:实验和计算见解","authors":"Hicham Zgueni , Mohammed El Mesky , Rahime Eshaghi Malekshah , Fatima Ennafaa , Mohamed Znini , El Houssine Mabrouk , Driss Chebabe","doi":"10.1016/j.molliq.2025.127116","DOIUrl":null,"url":null,"abstract":"<div><div>The objective of this work is the synthesis of new surfactants with polar head phenolphtalein and their inhibitive effect against carbon steel corrosion in acidic medium. Indeed, These compounds were synthesized by the action of the phénolphtalein on différents alkyl halides such as decyl bromide, undecyl bromide and dodecyl bromide. IR, <sup>1</sup>H NMR, <sup>13</sup>C NMRand mass spectra have confirmed the structure of the obtained surfactants PHC10, PHC11 and PHC12. Electrochemical techniques such as potentiodynamic polarization and electrochemical impedance spectroscopy, as well as the SEM/EDX surface analysis are used to evaluate the corrosion resistance of these surfactants. In addition, theoretical methods including molecular dynamics simulations and density functional theory are used to understand the mechanisms of interaction between surfactants and metal surface. The obtained results show that the synthesized surfactants significantly reduce corrosion rate, suggesting their potential application in industrial environments. This study contributes to the advancement of corrosion prevention strategies by integrating synthetic chemistry with electrochemical and theoretical analyses.</div></div>","PeriodicalId":371,"journal":{"name":"Journal of Molecular Liquids","volume":"424 ","pages":"Article 127116"},"PeriodicalIF":5.2000,"publicationDate":"2025-04-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Synthesis, structural characterization and inhibition effects of new bicatenar surfactants based of phenolphtalein on the corrosion of carbon steel in 1 M HCl: Experimental and computational insights\",\"authors\":\"Hicham Zgueni , Mohammed El Mesky , Rahime Eshaghi Malekshah , Fatima Ennafaa , Mohamed Znini , El Houssine Mabrouk , Driss Chebabe\",\"doi\":\"10.1016/j.molliq.2025.127116\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>The objective of this work is the synthesis of new surfactants with polar head phenolphtalein and their inhibitive effect against carbon steel corrosion in acidic medium. Indeed, These compounds were synthesized by the action of the phénolphtalein on différents alkyl halides such as decyl bromide, undecyl bromide and dodecyl bromide. IR, <sup>1</sup>H NMR, <sup>13</sup>C NMRand mass spectra have confirmed the structure of the obtained surfactants PHC10, PHC11 and PHC12. Electrochemical techniques such as potentiodynamic polarization and electrochemical impedance spectroscopy, as well as the SEM/EDX surface analysis are used to evaluate the corrosion resistance of these surfactants. In addition, theoretical methods including molecular dynamics simulations and density functional theory are used to understand the mechanisms of interaction between surfactants and metal surface. The obtained results show that the synthesized surfactants significantly reduce corrosion rate, suggesting their potential application in industrial environments. This study contributes to the advancement of corrosion prevention strategies by integrating synthetic chemistry with electrochemical and theoretical analyses.</div></div>\",\"PeriodicalId\":371,\"journal\":{\"name\":\"Journal of Molecular Liquids\",\"volume\":\"424 \",\"pages\":\"Article 127116\"},\"PeriodicalIF\":5.2000,\"publicationDate\":\"2025-04-15\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Molecular Liquids\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S016773222500282X\",\"RegionNum\":2,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"2025/2/10 0:00:00\",\"PubModel\":\"Epub\",\"JCR\":\"Q2\",\"JCRName\":\"CHEMISTRY, PHYSICAL\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Molecular Liquids","FirstCategoryId":"92","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S016773222500282X","RegionNum":2,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"2025/2/10 0:00:00","PubModel":"Epub","JCR":"Q2","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
Synthesis, structural characterization and inhibition effects of new bicatenar surfactants based of phenolphtalein on the corrosion of carbon steel in 1 M HCl: Experimental and computational insights
The objective of this work is the synthesis of new surfactants with polar head phenolphtalein and their inhibitive effect against carbon steel corrosion in acidic medium. Indeed, These compounds were synthesized by the action of the phénolphtalein on différents alkyl halides such as decyl bromide, undecyl bromide and dodecyl bromide. IR, 1H NMR, 13C NMRand mass spectra have confirmed the structure of the obtained surfactants PHC10, PHC11 and PHC12. Electrochemical techniques such as potentiodynamic polarization and electrochemical impedance spectroscopy, as well as the SEM/EDX surface analysis are used to evaluate the corrosion resistance of these surfactants. In addition, theoretical methods including molecular dynamics simulations and density functional theory are used to understand the mechanisms of interaction between surfactants and metal surface. The obtained results show that the synthesized surfactants significantly reduce corrosion rate, suggesting their potential application in industrial environments. This study contributes to the advancement of corrosion prevention strategies by integrating synthetic chemistry with electrochemical and theoretical analyses.
期刊介绍:
The journal includes papers in the following areas:
– Simple organic liquids and mixtures
– Ionic liquids
– Surfactant solutions (including micelles and vesicles) and liquid interfaces
– Colloidal solutions and nanoparticles
– Thermotropic and lyotropic liquid crystals
– Ferrofluids
– Water, aqueous solutions and other hydrogen-bonded liquids
– Lubricants, polymer solutions and melts
– Molten metals and salts
– Phase transitions and critical phenomena in liquids and confined fluids
– Self assembly in complex liquids.– Biomolecules in solution
The emphasis is on the molecular (or microscopic) understanding of particular liquids or liquid systems, especially concerning structure, dynamics and intermolecular forces. The experimental techniques used may include:
– Conventional spectroscopy (mid-IR and far-IR, Raman, NMR, etc.)
– Non-linear optics and time resolved spectroscopy (psec, fsec, asec, ISRS, etc.)
– Light scattering (Rayleigh, Brillouin, PCS, etc.)
– Dielectric relaxation
– X-ray and neutron scattering and diffraction.
Experimental studies, computer simulations (MD or MC) and analytical theory will be considered for publication; papers just reporting experimental results that do not contribute to the understanding of the fundamentals of molecular and ionic liquids will not be accepted. Only papers of a non-routine nature and advancing the field will be considered for publication.