The geometry of 2-mercaptobenzothiazole （MBT） and its tautomeric form of benzothiazole-2-thione are optimized at B3LYP/6-311 G＊＊ and HF/6-311 G＊＊ levels, respectively. The crystal structure of benzothiazole-2-th...The geometry of 2-mercaptobenzothiazole （MBT） and its tautomeric form of benzothiazole-2-thione are optimized at B3LYP/6-311 G＊＊ and HF/6-311 G＊＊ levels, respectively. The crystal structure of benzothiazole-2-thione and its FFIR spectra are also obtained. From the calculated and experimental data, it can be concluded that in gas-phase and solid-state, the real existing form of 2-mercaptobenzothiazole is the thione-form of MBT.展开更多
We investigated the effect of the 2-mercaptobenzothiazole concentration on the sour-corrosion behavior of API X60 pipeline steel in an environment containing H_(2)S at 25°C and in the presence of 0,2.5,5.0,7.5,an...We investigated the effect of the 2-mercaptobenzothiazole concentration on the sour-corrosion behavior of API X60 pipeline steel in an environment containing H_(2)S at 25°C and in the presence of 0,2.5,5.0,7.5,and 10.0 g/L of 2-mercaptobenzothiazole inhibitor.To examine this behavior,we conducted open-circuit potential(OCP),potentiodynamic polarization,and electrochemical impedance spectroscopy(EIS)tests.Energy dispersive spectroscopy and scanning electron microscopy were also used to analyze the corrosion products.The results of the OCP and potentiodynamic polarization tests revealed that 2-mercaptobenzothiazole reduces the speed of both the anodic and cathodic reactions.An assessment of the Gibbs free energy of the inhibitor(△G_(ads)^(■))indicated that its value was less than-20 kJ·mol^(-1)and greater than-40 k J·mol^(-1).Therefore,the adsorption of 2-mercaptobenzothiazole onto the surface of the API X60 pipeline steel occurs both physically and chemically,the latter of which is particularly intentional.In addition,as the△G_(ads)^(■)dsvalue was negative,we could conclude that the adsorption of 2-mercaptobenzothiazole onto the surface of the pipeline steel occurs spontaneously.The EIS results indicate that with the increase in the 2-mercaptobenzothiazole inhibitor concentration,the corrosion resistance of API X60 steel increases.An analysis of the corrosion products revealed that iron sulfide compounds form on the surface.In summary,the results showed that an increase in the inhibitor concentration results in a decrease in the corrosion rate and an increase in inhibitory efficiency.Additionally,we found that the 2-mercaptobenzothiazole adsorption process on the API X60 steel surfaces in an H2 S-containing environment follows the Langmuir adsorption isotherm and occurs spontaneously.展开更多
Interfacial proton transfer reactions of pure mercaptoacetic acid (MA) and 2-mercaptobenzothiazole (Mbz) mixed self-assembled monolayers (SAMs) have been studied using a.c. impedance titration method. The charge-trans...Interfacial proton transfer reactions of pure mercaptoacetic acid (MA) and 2-mercaptobenzothiazole (Mbz) mixed self-assembled monolayers (SAMs) have been studied using a.c. impedance titration method. The charge-transfer resistance (Rct,) is measured with the monolayer composition and the ionic strength of pH solution. The surface pKa can be obtained by the plots of Rct and pH, the reasons of shifts of surface pKa are also explained.展开更多
Cyclic voltammetry is used to study the electrochemical behavior of CoCl 2, Co(dppe) 2Cl 2 and Co(mbt S,N) 2(dppe) [Hmbt=2 mercaptobenzothiazole; dppe=1,2 (diphenylphosphino)] in DMF or MeCN solution with 0...Cyclic voltammetry is used to study the electrochemical behavior of CoCl 2, Co(dppe) 2Cl 2 and Co(mbt S,N) 2(dppe) [Hmbt=2 mercaptobenzothiazole; dppe=1,2 (diphenylphosphino)] in DMF or MeCN solution with 0.1 mol·L -1 Bu n 4NBF 4 as electrolyte on the Pt electrode. The results indicate that the reduction potential, transfer coefficient and diffusion coefficient of Co(Ⅱ), Co(dppe)(Ⅱ) and Co(mbt S,N) 2(dppe) in DMF and MeCN depend on the solvent coordinated species, the volume and structure of ion. This is the characterization of the synergistic coordination effect.展开更多
The adsorption behavior of 2-mercaptobenzothiazole onto organo-bentonite was investigated. Natural bentonite from Gaozhou in Guangdong Province, China was collected. Organo-bentonite was prepared by intercalation of c...The adsorption behavior of 2-mercaptobenzothiazole onto organo-bentonite was investigated. Natural bentonite from Gaozhou in Guangdong Province, China was collected. Organo-bentonite was prepared by intercalation of cetyltrimethyl ammonium bromide into the natural bentonite. The physicochemical properties of the prepared organo-bentonite were characterized by X-ray diffraction, N2 adsorption-desorption isotherm and Fourier transform infrared spectroscopy. The results showed that montmorillonite is the main component of the natural bentonite. The basal spacing of the natural bentonite is 1.47 nm, which increased to 1.98 nm on intercalation with cetyltrimethyl ammonium bromide. Moreover, both the surface area and pore volume increased with intercalation. Clear CH2 stretching （3000-2800 cm-1） and scissoring （1480-1450 cm-1） modes of the intercalated surfactants were observed for organo- bentonite. Compared with the pseudo first-order kinetic model, the pseudo second-order kinetic model is more suitable to describe the adsorption kinetics of 2-mercaptobenzothiazole onto organo-bentonite. The adsorption capacity of 2-mercaptobenzothiazole onto organo-bentonite increased with increasing initial concentration of 2-mercaptobenzothiazole, but decreased with increasing adsorbent dosage. The adsorption isotherm of 2-mercaptobenzothiazole onto organo-bentonite fits well with the Langmuir model. The maximum adsorption capacity of organo-bentonite for 2-mercaptobenzothiazole was 33.61 mg/g, indicating that organo-bentonite is a promising adsorbent for 2-mercaptobenzothiazole.展开更多
Recently, water treatment by ionizing radiation has gained increasing attention as a powerful technology for the destruction of refractory pollutants. 2-Mercaptobenzothiazole（MBT） is known as a widespread, toxic and...Recently, water treatment by ionizing radiation has gained increasing attention as a powerful technology for the destruction of refractory pollutants. 2-Mercaptobenzothiazole（MBT） is known as a widespread, toxic and poorly biodegradable pollutant. This paper studied the gamma irradiation of aqueous solutions of MBT. Moreover, the effect of the addition of persulfate（S2O82-） on the radiolytic destruction of MBT was investigated. The main transformation products of the studied compound were detected and the sequence of occurrence of the products was described. The change of biodegradability of MBT solution was also observed. The main results obtained in this study indicated that gamma radiation was effective for removing MBT in aqueous solution. Persulfate addition, which induced the formation of reactive sulfate radicals（SO4-U）, greatly enhanced the degradation of MBT. Benzothiazole was identified as the first radiation product, followed by 2-hydroxybenzothiazole. Decomposition of MBT started with the oxidation of –SH groups to sulfate ions. Possible pathways for MBT decomposition by gamma irradiation were proposed. The BOD/COD ratios of MBT samples were increased after radiation,indicating the improvement of biodegradability and reduction of toxicity.展开更多
Recently, ling et al. （2013） published the paper entitled as above. In Section 2.3, Adsorption kinetics of MBT, authors noticed that ＂The pseudo first-order kinetic model （Eq. （1）） and the pseudo second-order k...Recently, ling et al. （2013） published the paper entitled as above. In Section 2.3, Adsorption kinetics of MBT, authors noticed that ＂The pseudo first-order kinetic model （Eq. （1）） and the pseudo second-order kinetic model （Eq. （2））＂ were used （Do,an et al., 2007; Eftekhari et al., 2010）：展开更多
基金This work was supported by the Natural Science Foundation of Shandong Province (No.Y2002B06)
文摘The geometry of 2-mercaptobenzothiazole （MBT） and its tautomeric form of benzothiazole-2-thione are optimized at B3LYP/6-311 G＊＊ and HF/6-311 G＊＊ levels, respectively. The crystal structure of benzothiazole-2-thione and its FFIR spectra are also obtained. From the calculated and experimental data, it can be concluded that in gas-phase and solid-state, the real existing form of 2-mercaptobenzothiazole is the thione-form of MBT.
文摘We investigated the effect of the 2-mercaptobenzothiazole concentration on the sour-corrosion behavior of API X60 pipeline steel in an environment containing H_(2)S at 25°C and in the presence of 0,2.5,5.0,7.5,and 10.0 g/L of 2-mercaptobenzothiazole inhibitor.To examine this behavior,we conducted open-circuit potential(OCP),potentiodynamic polarization,and electrochemical impedance spectroscopy(EIS)tests.Energy dispersive spectroscopy and scanning electron microscopy were also used to analyze the corrosion products.The results of the OCP and potentiodynamic polarization tests revealed that 2-mercaptobenzothiazole reduces the speed of both the anodic and cathodic reactions.An assessment of the Gibbs free energy of the inhibitor(△G_(ads)^(■))indicated that its value was less than-20 kJ·mol^(-1)and greater than-40 k J·mol^(-1).Therefore,the adsorption of 2-mercaptobenzothiazole onto the surface of the API X60 pipeline steel occurs both physically and chemically,the latter of which is particularly intentional.In addition,as the△G_(ads)^(■)dsvalue was negative,we could conclude that the adsorption of 2-mercaptobenzothiazole onto the surface of the pipeline steel occurs spontaneously.The EIS results indicate that with the increase in the 2-mercaptobenzothiazole inhibitor concentration,the corrosion resistance of API X60 steel increases.An analysis of the corrosion products revealed that iron sulfide compounds form on the surface.In summary,the results showed that an increase in the inhibitor concentration results in a decrease in the corrosion rate and an increase in inhibitory efficiency.Additionally,we found that the 2-mercaptobenzothiazole adsorption process on the API X60 steel surfaces in an H2 S-containing environment follows the Langmuir adsorption isotherm and occurs spontaneously.
文摘Interfacial proton transfer reactions of pure mercaptoacetic acid (MA) and 2-mercaptobenzothiazole (Mbz) mixed self-assembled monolayers (SAMs) have been studied using a.c. impedance titration method. The charge-transfer resistance (Rct,) is measured with the monolayer composition and the ionic strength of pH solution. The surface pKa can be obtained by the plots of Rct and pH, the reasons of shifts of surface pKa are also explained.
文摘Cyclic voltammetry is used to study the electrochemical behavior of CoCl 2, Co(dppe) 2Cl 2 and Co(mbt S,N) 2(dppe) [Hmbt=2 mercaptobenzothiazole; dppe=1,2 (diphenylphosphino)] in DMF or MeCN solution with 0.1 mol·L -1 Bu n 4NBF 4 as electrolyte on the Pt electrode. The results indicate that the reduction potential, transfer coefficient and diffusion coefficient of Co(Ⅱ), Co(dppe)(Ⅱ) and Co(mbt S,N) 2(dppe) in DMF and MeCN depend on the solvent coordinated species, the volume and structure of ion. This is the characterization of the synergistic coordination effect.
基金supported by the National Natural Science Foundation of China (No. 41171250,20907011)
文摘The adsorption behavior of 2-mercaptobenzothiazole onto organo-bentonite was investigated. Natural bentonite from Gaozhou in Guangdong Province, China was collected. Organo-bentonite was prepared by intercalation of cetyltrimethyl ammonium bromide into the natural bentonite. The physicochemical properties of the prepared organo-bentonite were characterized by X-ray diffraction, N2 adsorption-desorption isotherm and Fourier transform infrared spectroscopy. The results showed that montmorillonite is the main component of the natural bentonite. The basal spacing of the natural bentonite is 1.47 nm, which increased to 1.98 nm on intercalation with cetyltrimethyl ammonium bromide. Moreover, both the surface area and pore volume increased with intercalation. Clear CH2 stretching （3000-2800 cm-1） and scissoring （1480-1450 cm-1） modes of the intercalated surfactants were observed for organo- bentonite. Compared with the pseudo first-order kinetic model, the pseudo second-order kinetic model is more suitable to describe the adsorption kinetics of 2-mercaptobenzothiazole onto organo-bentonite. The adsorption capacity of 2-mercaptobenzothiazole onto organo-bentonite increased with increasing initial concentration of 2-mercaptobenzothiazole, but decreased with increasing adsorbent dosage. The adsorption isotherm of 2-mercaptobenzothiazole onto organo-bentonite fits well with the Langmuir model. The maximum adsorption capacity of organo-bentonite for 2-mercaptobenzothiazole was 33.61 mg/g, indicating that organo-bentonite is a promising adsorbent for 2-mercaptobenzothiazole.
基金the National Hi-Tech Research and Development Program(863)of China(No.2009AA063905)supported by the Chinese Ministry of Science and Technology and the Independent Research Project(No.20101081929)supported by Tsinghua University
文摘Recently, water treatment by ionizing radiation has gained increasing attention as a powerful technology for the destruction of refractory pollutants. 2-Mercaptobenzothiazole（MBT） is known as a widespread, toxic and poorly biodegradable pollutant. This paper studied the gamma irradiation of aqueous solutions of MBT. Moreover, the effect of the addition of persulfate（S2O82-） on the radiolytic destruction of MBT was investigated. The main transformation products of the studied compound were detected and the sequence of occurrence of the products was described. The change of biodegradability of MBT solution was also observed. The main results obtained in this study indicated that gamma radiation was effective for removing MBT in aqueous solution. Persulfate addition, which induced the formation of reactive sulfate radicals（SO4-U）, greatly enhanced the degradation of MBT. Benzothiazole was identified as the first radiation product, followed by 2-hydroxybenzothiazole. Decomposition of MBT started with the oxidation of –SH groups to sulfate ions. Possible pathways for MBT decomposition by gamma irradiation were proposed. The BOD/COD ratios of MBT samples were increased after radiation,indicating the improvement of biodegradability and reduction of toxicity.
文摘Recently, ling et al. （2013） published the paper entitled as above. In Section 2.3, Adsorption kinetics of MBT, authors noticed that ＂The pseudo first-order kinetic model （Eq. （1）） and the pseudo second-order kinetic model （Eq. （2））＂ were used （Do,an et al., 2007; Eftekhari et al., 2010）：
