Citation:
LI Xiang-Hong, XIE Xiao-Guang. Inhibition Effect of Pyrimidine Derivatives on the Corrosion of Steel in Hydrochloric Acid Solution[J]. Acta Physico-Chimica Sinica,
;2013, 29(10): 2221-2231.
doi:
10.3866/PKU.WHXB201307301
-
The inhibition effect of two pyrimidine derivatives, 2- hydroxypyrimidine (HP) and 2- mercaptopyrimidine (MP), on the corrosion of cold rolled steel (CRS) in 1.0-5.0 mol·L-1 HCl is investigated by mass loss, potentiodynamic polarization curves, electrochemical impedance spectroscopy (EIS), and quantum chemical calculations. The results show that HP and MP are both od inhibitors of corrosion of CRS in 1.0 mol·L-1 HCl solution. The adsorption of these inhibitors onto the CRS surface obeys the Langmuir adsorption isotherm. Inhibition efficiency increases with inhibitor concentration, and decreases with hydrochloric acid concentration. The thermodynamic parameters of adsorption (adsorption equilibrium constant (K) and adsorption free energy (ΔG0)) and kinetic parameters of corrosion (apparent activation energy (Ea), pre-exponential factor (A), corrosion rate constant (k), and kinetic reaction constant (B)) are also calculated. Based on these parameters, the mechanism of inhibition is discussed. Potentiodynamic polarization curves show that HP and MP act as mixed-type inhibitors. EIS exhibit one capacitive loop, and the charge transfer resistance increases with inhibitor concentration. The results of quantum chemical calculations indicate that MP exhibits higher adsorptive ability than HP, which is in od agreement with the experimental data.
-
-
-
[1]
(1) Li, X. H.; Deng, S. D.; Fu, H. Acta Phys. -Chim. Sin. 2011, 27,2841. [李向红, 邓书端,付惠.物理化学学报, 2011, 27,2841.] doi: 10.3866/PKU.WHXB20112841
-
[2]
(2) Bentiss, F.; Traisnel, M.; Gengembre, L.; Lagrenée, M. Appl. Surf. Sci. 1999, 152, 237. doi: 10.1016/S0169-4332(99)00322-0
-
[3]
(3) Yan, Y.; Li, W. H.; Cai, L. K.; Hou, B. R. Electrochim. Acta2008, 53, 5953. doi: 10.1016/j.electacta.2008.03.065
-
[4]
(4) Wang, L. J. Yunnan Univ. 2001, 23, 203. [王林.云南大学学报, 2001, 23, 203.]
-
[5]
(5) Monticell, C.; Brunoro, G.; Frignani, A. J. Electrochem. Soc.1992, 139, 706.
-
[6]
(6) Lin, Z. H.; Wang, F. C.; Tian, Z. Q. Acta Phys. -Chim. Sin. 1992,8, 87. [林仲华, 王逢春,田中群. 物理化学学报, 1992, 8, 87.]doi: 10.3866/PKU.WHXB19920116
-
[7]
(7) Zucchi, F.; Trabanelli, G.; Brunoro, G. Mater. Corros. 1993, 44,264.
-
[8]
(8) Wang, L. Corrosion Sci. 2001, 41, 1637.
-
[9]
(9) Li, X. H.; Deng, S. D.; Fu, H. Chin. J. Appl. Chem. 2012, 29,209. [李向红, 邓书端,付惠.应用化学, 2012, 29, 209.]
-
[10]
(10) Makhlouf, M. T.; El-Shahawy, A. S.; El-Shatory, S. A. Mater. Chem. Phys. 1996, 43, 153. doi: 10.1016/0254-0584(95)01611-W
-
[11]
(11) Li, X. H.; Deng, S. D.; Fu, H. Corrosion Sci. 2009, 51, 1344.doi: 10.1016/j.corsci.2009.03.023
-
[12]
(12) Kokalj, A.; Peljhan, S.; Finšgar, M.; Milošev, I. J. Am. Chem. Soc. 2010, 132, 16657. doi: 10.1021/ja107704y
-
[13]
(13) Feng, L. J.; Yang, H. Y.; Wang, F. H. Electrochim. Acta 2011,58, 427. doi: 10.1016/j.electacta.2011.09.063
-
[14]
(14) El Adnani, Z.; Mcharfi, M.; Sfaira, M.; Benzakour, M.;Benjelloun, A. T.; Ebn Touhami, M. Corrosion Sci. 2013, 68,223. doi: 10.1016/j.corsci.2012.11.020
-
[15]
(15) Zhang, J.; Zhao, W. M.; Guo, W. Y.; Wang, Y.; Li, Z. P. Acta Phys. -Chim. Sin. 2008, 24, 1239. [张军,赵卫民,郭文跃,王勇,李中谱. 物理化学学报, 2008, 24, 1239.] doi: 10.3866/PKU.WHXB20080720
-
[16]
(16) Materials Studio 4.1; Accelrys Inc.: San Die , CA, 2006.
-
[17]
(17) Becke, A. D. J. Chem. Phys. 1988, 88, 2547. doi: 10.1063/1.454033
-
[18]
(18) Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B 1988, 37, 785. doi: 10.1103/PhysRevB.37.785
-
[19]
(19) Klamt, A.; Schüürmann, G. J. Chem. Soc. Perkin. Trans. 1993,2, 799.
-
[20]
(20) Cano, E.; Polo, J. L.; Iglesia, A. L.; Bastidas, J. M. Adsorption2004, 10, 219. doi: 10.1023/B:ADSO.0000046358.35572.4c
-
[21]
(21) Zhang, F.; Tang, Y. M.; Cao, Z. Y.; Jing, W. H.; Wu, Z. L.; Chen,Y. Z. Corrosion Sci. 2012, 61, 1. doi: 10.1016/j.corsci.2012.03.045
-
[22]
(22) Behpour, M.; Ghoreishi, S. M.; Soltani, N.; Salavati-Niasari, M.Corrosion Sci. 2009, 51, 1073. doi: 10.1016/j.corsci.2009.02.011
-
[23]
(23) Bentiss, F.; Lebrini, M.; Lagrenée, M. Corrosion Sci. 2005, 47,2915. doi: 10.1016/j.corsci.2005.05.034
-
[24]
(24) Vra?ar, L. M.; Dra??, D. M. Corrosion Sci. 2002, 44, 1669. doi: 10.1016/S0010-938X(01)00166-4
-
[25]
(25) Solmaz, R.; Kardas, G.; Yazici, B.; Erbil, M. Colloids Surf. A2008, 312, 7. doi: 10.1016/j.colsurfa.2007.06.035
-
[26]
(26) Moretti, G.; Guidi, F.; Grion, G. Corrosion Sci. 2004, 46, 387.doi: 10.1016/S0010-938X(03)00150-1
-
[27]
(27) Li, X. H.; Deng, S. D.; Mu, G. N.; Fu, H.; Yang, F. Z. Corrosion Sci. 2008, 50, 420. doi: 10.1016/j.corsci.2007.08.014
-
[28]
(28) Granese, S. L.; Rosales, B. M.; Oviede, C.; Zerbino, J. O.Corrosion Sci. 1992, 33, 1439. doi: 10.1016/0010-938X(92)90182-3
-
[29]
(29) Mathur, P. B.; Vasudevan, T. Corrosion 1982, 38, 171. doi: 10.5006/1.3579270
-
[30]
(30) Cao, C. Corrosion Sci. 1996, 38, 2073. doi: 10.1016/S0010-938X(96)00034-0
-
[31]
(31) Behpour, M.; Ghoreishi, S. M.; Mohammadi, N.; Soltani, N.;Salavati-Niasari, M. Corrosion Sci. 2010, 52, 4046. doi: 10.1016/j.corsci.2010.08.020
-
[32]
(32) Labjar, N.; Lebrini, M.; Bentiss, F.; Chihib, N. E.; El Hajjaji, S.;Jama, C. Mater. Chem. Phys. 2010, 119, 330. doi: 10.1016/j.matchemphys.2009.09.006
-
[33]
(33) Lebrini, M.; Lagrenée, M.; Vezin, H.; Traisnel, M.; Bentiss, F.Corrosion Sci. 2007, 49, 2254. doi: 10.1016/j.corsci.2006.10.029
-
[34]
(34) Priya, A. R. S.; Muralidharam, V. S.; Subramania, A. Corrosion2008, 64, 541. doi: 10.5006/1.3278490
-
[35]
(35) Osório, W. R.; Moutinho, D. J.; Peixoto, L. C.; Ferreira, I. L.;Garcia, A. Electrochim. Acta 2011, 56, 8412. doi: 10.1016/j.electacta.2011.07.028
-
[36]
(36) Lagrenée, M.; Mernari, B.; Bouanis, M.; Traisnel, M.; Bentiss,F. Corrosion Sci. 2002, 44, 573. doi: 10.1016/S0010-938X(01)00075-0
-
[37]
(37) Li, D. Z.; Zhang, S. G.; Bian, H.; Zhang, L. C. Comput. Appl. Chem. 2009, 26, 324. [李大枝, 张士国,卞贺,张立超.计算机与应用化学, 2009, 26, 324. ]
-
[38]
(38) Parr, R. G.; Yang, W. J. Am. Chem. Soc. 1984, 106, 4049. doi: 10.1021/ja00326a036
-
[39]
(39) Gómez, B.; Likhanova, N. V.; Aguilar, M. A. D.; Olivares, O.;Hallen, J. M.; Martínez-Magadán, J. M. J. Phys. Chem. A 2005,109, 8950. doi: 10.1021/jp052188k
-
[40]
(40) Lashkari, M.; Arshadi, M. R. Chem. Phys. 2004, 299, 131. doi: 10.1016/j.chemphys.2003.12.019
-
[41]
(41) Schweinsberg, D. P.; Ashworth, V. Corrosion Sci. 1988, 28, 539.doi: 10.1016/0010-938X(88)90022-4
-
[42]
(42) Banerjee, G.; Malhotra, S. N. Corrosion 1992, 48, 10. doi: 10.5006/1.3315912
-
[43]
(43) Feng, Y.; Chen, S.; Zhang, H.; Li, P.;Wu, L.; Guo, W. Appl. Surf. Sci. 2006, 253, 2812. doi: 10.1016/j.apsusc.2006.05.061
-
[44]
(44) Ju, H.; Kai, Z. P.; Li, Y. Corrosion Sci. 2008, 50, 865. doi: 10.1016/j.corsci.2007.10.009
-
[45]
(45) Lukovits, I.; Kálmán, E.; Zucchi, F. Corrosion 2001, 57, 3. doi: 10.5006/1.3290328
-
[46]
(46) Sastri, V. S.; Perumareddi, J. R. Corrosion 1997, 53, 617. doi: 10.5006/1.3290294
-
[47]
(47) Awad, M. K.; Mustafa, M. R.; Elnga, M. M. A. J. Mol. Struct. -Theochem 2010, 959, 66. doi: 10.1016/j.theochem.2010.08.008
-
[1]
-
-
-
[1]
Jingke LIU , Jia CHEN , Yingchao HAN . Nano hydroxyapatite stable suspension system: Preparation and cobalt adsorption performance. Chinese Journal of Inorganic Chemistry, 2024, 40(9): 1763-1774. doi: 10.11862/CJIC.20240060
-
[2]
Xueli Mu , Lingli Han , Tao Liu . Quantum Chemical Calculation Study on the E2 Elimination Reaction of Halohydrocarbon: Designing a Computational Chemistry Experiment. University Chemistry, 2025, 40(3): 68-75. doi: 10.12461/PKU.DXHX202404057
-
[3]
Zeyu XU , Anlei DANG , Bihua DENG , Xiaoxin ZUO , Yu LU , Ping YANG , Wenzhu YIN . Evaluation of the efficacy of graphene oxide quantum dots as an ovalbumin delivery platform and adjuvant for immune enhancement. Chinese Journal of Inorganic Chemistry, 2024, 40(6): 1065-1078. doi: 10.11862/CJIC.20240099
-
[4]
Guang Huang , Lei Li , Dingyi Zhang , Xingze Wang , Yugai Huang , Wenhui Liang , Zhifen Guo , Wenmei Jiao . Cobalt’s Valor, Nickel’s Foe: A Comprehensive Chemical Experiment Utilizing a Cobalt-based Imidazolate Framework for Nickel Ion Removal. University Chemistry, 2024, 39(8): 174-183. doi: 10.3866/PKU.DXHX202311051
-
[5]
Huiying Xu , Minghui Liang , Zhi Zhou , Hui Gao , Wei Yi . Application of Quantum Chemistry Computation and Visual Analysis in Teaching of Weak Interactions. University Chemistry, 2025, 40(3): 199-205. doi: 10.12461/PKU.DXHX202407011
-
[6]
Peng XU , Shasha WANG , Nannan CHEN , Ao WANG , Dongmei YU . Preparation of three-layer magnetic composite Fe3O4@polyacrylic acid@ZiF-8 for efficient removal of malachite green in water. Chinese Journal of Inorganic Chemistry, 2024, 40(3): 544-554. doi: 10.11862/CJIC.20230239
-
[7]
Jing Wang , Pingping Li , Yuehui Wang , Yifan Xiu , Bingqian Zhang , Shuwen Wang , Hongtao Gao . Treatment and Discharge Evaluation of Phosphorus-Containing Wastewater. University Chemistry, 2024, 39(5): 52-62. doi: 10.3866/PKU.DXHX202309097
-
[8]
Fugui XI , Du LI , Zhourui YAN , Hui WANG , Junyu XIANG , Zhiyun DONG . Functionalized zirconium metal-organic frameworks for the removal of tetracycline from water. Chinese Journal of Inorganic Chemistry, 2025, 41(4): 683-694. doi: 10.11862/CJIC.20240291
-
[9]
Shuanglin TIAN , Tinghong GAO , Yutao LIU , Qian CHEN , Quan XIE , Qingquan XIAO , Yongchao LIANG . First-principles study of adsorption of Cl2 and CO gas molecules by transition metal-doped g-GaN. Chinese Journal of Inorganic Chemistry, 2024, 40(6): 1189-1200. doi: 10.11862/CJIC.20230482
-
[10]
Aili Feng , Xin Lu , Peng Liu , Dongju Zhang . Computational Chemistry Study of Acid-Catalyzed Esterification Reactions between Carboxylic Acids and Alcohols. University Chemistry, 2025, 40(3): 92-99. doi: 10.12461/PKU.DXHX202405072
-
[11]
Supin Zhao , Jing Xie . Understanding the Vibrational Stark Effect of Water Molecules Using Quantum Chemistry Calculations. University Chemistry, 2025, 40(3): 178-185. doi: 10.12461/PKU.DXHX202406024
-
[12]
Fei Xie , Chengcheng Yuan , Haiyan Tan , Alireza Z. Moshfegh , Bicheng Zhu , Jiaguo Yu . d带中心调控过渡金属单原子负载COF吸附O2的理论计算研究. Acta Physico-Chimica Sinica, 2024, 40(11): 2407013-. doi: 10.3866/PKU.WHXB202407013
-
[13]
Yanan Jiang , Yuchen Ma . Brief Discussion on the Electronic Exchange Interaction in Quantum Chemistry Computations. University Chemistry, 2025, 40(3): 10-15. doi: 10.12461/PKU.DXHX202402058
-
[14]
Yaqin Zheng , Lian Zhuo , Meng Li , Chunying Rong . Enhancing Understanding of the Electronic Effect of Substituents on Benzene Rings Using Quantum Chemistry Calculations. University Chemistry, 2025, 40(3): 193-198. doi: 10.12461/PKU.DXHX202406119
-
[15]
Jie ZHAO , Sen LIU , Qikang YIN , Xiaoqing LU , Zhaojie WANG . Theoretical calculation of selective adsorption and separation of CO2 by alkali metal modified naphthalene/naphthalenediyne. Chinese Journal of Inorganic Chemistry, 2024, 40(3): 515-522. doi: 10.11862/CJIC.20230385
-
[16]
Jianjun LI , Mingjie REN , Lili ZHANG , Lingling ZENG , Huiling WANG , Xiangwu MENG . UV-assisted degradation of tetracycline hydrochloride by MnFe2O4@activated carbon activated persulfate. Chinese Journal of Inorganic Chemistry, 2024, 40(10): 1869-1880. doi: 10.11862/CJIC.20240187
-
[17]
Jiabo Huang , Quanxin Li , Zhongyan Cao , Li Dang , Shaofei Ni . Elucidating the Mechanism of Beckmann Rearrangement Reaction Using Quantum Chemical Calculations. University Chemistry, 2025, 40(3): 153-159. doi: 10.12461/PKU.DXHX202405172
-
[18]
Wenkai Chen , Yunjia Shen , Xiangmeng Kong , Yanli Zeng . Quantum Chemistry Calculation of Key Physical Quantity in Circularly Polarized Luminescence: Introducing an Exploratory Computational Chemistry Experiment. University Chemistry, 2025, 40(3): 83-91. doi: 10.12461/PKU.DXHX202405018
-
[19]
Jia Zhou . Constructing Potential Energy Surface of Water Molecule by Quantum Chemistry and Machine Learning: Introduction to a Comprehensive Computational Chemistry Experiment. University Chemistry, 2024, 39(3): 351-358. doi: 10.3866/PKU.DXHX202309060
-
[20]
Shasha Ma , Zujin Yang , Jianyong Zhang . Facile Synthesis of FeBTC Metal-Organic Gel and Its Adsorption of Cr2O72−: A Physical Chemistry Innovation Experiment. University Chemistry, 2024, 39(8): 314-323. doi: 10.3866/PKU.DXHX202401008
-
[1]
Metrics
- PDF Downloads(586)
- Abstract views(1180)
- HTML views(5)