Synthesis and investigation of pyran derivatives as acidizing corrosion inhibitors for N80 steel in hydrochloric acid: Theoretical and experimental approaches

Ambrish Singh; K. R. Ansari; M. A. Quraishi; Hassane Lgaz; Yuanhua Lin

doi:10.1016/j.jallcom.2018.05.236

Synthesis and investigation of pyran derivatives as acidizing corrosion inhibitors for N80 steel in hydrochloric acid: Theoretical and experimental approaches

Ambrish Singh^*, K. R. Ansari, M. A. Quraishi, Hassane Lgaz, Yuanhua Lin

^*Corresponding author for this work

Interdisciplinary Research Center for Advanced Materials

Research output: Contribution to journal › Article › peer-review

217 Scopus citations

Abstract

The corrosion inhibition performance of pyran derivatives (AP) on N80 steel in 15% HCl was investigated by electrochemical impedance spectroscopy (EIS), potentiodynamic polarization, weight loss, contact angle and scanning electron microscopy (SEM) measurements, DFT and molecular dynamic simulation. The adsorption of APs on the surface of N80 steel obeyed Langmuir isotherm. Potentiodynamic polarization study confirmed that inhibitors are mixed type with cathodic predominance. Molecular dynamic simulation was applied to search for most stable configuration and adsorption energies for the interaction of the inhibitors with Fe (110) surface. The theoretical data obtained are in most cases in agreement with experimental results.

Original language	English
Pages (from-to)	347-362
Number of pages	16
Journal	Journal of Alloys and Compounds
Volume	762
DOIs	https://doi.org/10.1016/j.jallcom.2018.05.236
State	Published - 25 Sep 2018

Bibliographical note

Publisher Copyright:
© 2018 Elsevier B.V.

Keywords

Acidizing inhibitor
DFT
EIS
Molecular simulation
N80 steel
Pyran derivatives

ASJC Scopus subject areas

Mechanics of Materials
Mechanical Engineering
Metals and Alloys
Materials Chemistry

Access to Document

10.1016/j.jallcom.2018.05.236

Cite this

@article{08894ac6bb7c4e7dadc510a8f34be8b0,

title = "Synthesis and investigation of pyran derivatives as acidizing corrosion inhibitors for N80 steel in hydrochloric acid: Theoretical and experimental approaches",

abstract = "The corrosion inhibition performance of pyran derivatives (AP) on N80 steel in 15\% HCl was investigated by electrochemical impedance spectroscopy (EIS), potentiodynamic polarization, weight loss, contact angle and scanning electron microscopy (SEM) measurements, DFT and molecular dynamic simulation. The adsorption of APs on the surface of N80 steel obeyed Langmuir isotherm. Potentiodynamic polarization study confirmed that inhibitors are mixed type with cathodic predominance. Molecular dynamic simulation was applied to search for most stable configuration and adsorption energies for the interaction of the inhibitors with Fe (110) surface. The theoretical data obtained are in most cases in agreement with experimental results.",

keywords = "Acidizing inhibitor, DFT, EIS, Molecular simulation, N80 steel, Pyran derivatives",

author = "Ambrish Singh and Ansari, \{K. R.\} and Quraishi, \{M. A.\} and Hassane Lgaz and Yuanhua Lin",

note = "Publisher Copyright: {\textcopyright} 2018 Elsevier B.V.",

year = "2018",

month = sep,

day = "25",

doi = "10.1016/j.jallcom.2018.05.236",

language = "English",

volume = "762",

pages = "347--362",

journal = "Journal of Alloys and Compounds",

issn = "0925-8388",

}

TY - JOUR

T1 - Synthesis and investigation of pyran derivatives as acidizing corrosion inhibitors for N80 steel in hydrochloric acid

T2 - Theoretical and experimental approaches

AU - Singh, Ambrish

AU - Ansari, K. R.

AU - Quraishi, M. A.

AU - Lgaz, Hassane

AU - Lin, Yuanhua

PY - 2018/9/25

Y1 - 2018/9/25

N2 - The corrosion inhibition performance of pyran derivatives (AP) on N80 steel in 15% HCl was investigated by electrochemical impedance spectroscopy (EIS), potentiodynamic polarization, weight loss, contact angle and scanning electron microscopy (SEM) measurements, DFT and molecular dynamic simulation. The adsorption of APs on the surface of N80 steel obeyed Langmuir isotherm. Potentiodynamic polarization study confirmed that inhibitors are mixed type with cathodic predominance. Molecular dynamic simulation was applied to search for most stable configuration and adsorption energies for the interaction of the inhibitors with Fe (110) surface. The theoretical data obtained are in most cases in agreement with experimental results.

AB - The corrosion inhibition performance of pyran derivatives (AP) on N80 steel in 15% HCl was investigated by electrochemical impedance spectroscopy (EIS), potentiodynamic polarization, weight loss, contact angle and scanning electron microscopy (SEM) measurements, DFT and molecular dynamic simulation. The adsorption of APs on the surface of N80 steel obeyed Langmuir isotherm. Potentiodynamic polarization study confirmed that inhibitors are mixed type with cathodic predominance. Molecular dynamic simulation was applied to search for most stable configuration and adsorption energies for the interaction of the inhibitors with Fe (110) surface. The theoretical data obtained are in most cases in agreement with experimental results.

KW - Acidizing inhibitor

KW - DFT

KW - EIS

KW - Molecular simulation

KW - N80 steel

KW - Pyran derivatives

UR - https://www.scopus.com/pages/publications/85047434451

U2 - 10.1016/j.jallcom.2018.05.236

DO - 10.1016/j.jallcom.2018.05.236

M3 - Article

AN - SCOPUS:85047434451

SN - 0925-8388

VL - 762

SP - 347

EP - 362

JO - Journal of Alloys and Compounds

JF - Journal of Alloys and Compounds

ER -

Synthesis and investigation of pyran derivatives as acidizing corrosion inhibitors for N80 steel in hydrochloric acid: Theoretical and experimental approaches

Abstract

Bibliographical note

Keywords

ASJC Scopus subject areas

Access to Document

Fingerprint

Cite this