Utrecht University, Department of Earth Sciences, The Netherlands.
Utrecht University, Department of Earth Sciences, The Netherlands; Soil and Groundwater Systems, Deltares, Utrecht, The Netherlands.
Sci Total Environ. 2014 Jul 1;485-486:755-763. doi: 10.1016/j.scitotenv.2013.11.066. Epub 2013 Dec 2.
The use of permanganate solutions for in-situ chemical oxidation (ISCO) is a well-established groundwater remediation technology, particularly for targeting chlorinated ethenes. The kinetics of oxidation reactions is an important ISCO remediation design aspect that affects the efficiency and oxidant persistence. The overall rate of the ISCO reaction between oxidant and contaminant is typically described using a second-order kinetic model while the second-order rate constant is determined experimentally by means of a pseudo first order approach. However, earlier studies of chlorinated hydrocarbons have yielded a wide range of values for the second-order rate constants. Also, there is limited insight in the kinetics of permanganate reactions with fuel-derived groundwater contaminants such as toluene and ethanol. In this study, batch experiments were carried out to investigate and compare the oxidation kinetics of aqueous trichloroethylene (TCE), ethanol, and toluene in an aqueous potassium permanganate solution. The overall second-order rate constants were determined directly by fitting a second-order model to the data, instead of typically using the pseudo-first-order approach. The second-order reaction rate constants (M(-1) s(-1)) for TCE, toluene, and ethanol were 8.0×10(-1), 2.5×10(-4), and 6.5×10(-4), respectively. Results showed that the inappropriate use of the pseudo-first-order approach in several previous studies produced biased estimates of the second-order rate constants. In our study, this error was expressed as a function of the extent (P/N) in which the reactant concentrations deviated from the stoichiometric ratio of each oxidation reaction. The error associated with the inappropriate use of the pseudo-first-order approach is negatively correlated with the P/N ratio and reached up to 25% of the estimated second-order rate constant in some previous studies of TCE oxidation. Based on our results, a similar relation is valid for the other volatile organic compounds studied.
过锰酸钾溶液在原位化学氧化(ISCO)中的应用是一种成熟的地下水修复技术,尤其适用于氯化乙烯的处理。氧化反应动力学是 ISCO 修复设计的一个重要方面,影响着效率和氧化剂的持久性。氧化剂与污染物之间的 ISCO 反应的总速率通常使用二级动力学模型来描述,而二级速率常数则通过准一级方法实验确定。然而,早期对氯化烃的研究得出了广泛的二级速率常数值。此外,对于过锰酸钾与燃料衍生的地下水污染物(如甲苯和乙醇)的反应动力学,了解有限。在这项研究中,进行了批实验,以研究和比较在过锰酸钾溶液中三氯乙烯(TCE)、乙醇和甲苯的氧化动力学。通过将二级模型拟合到数据中,直接确定了总二级速率常数,而不是通常使用准一级方法。TCE、甲苯和乙醇的二级反应速率常数(M(-1) s(-1))分别为 8.0×10(-1)、2.5×10(-4)和 6.5×10(-4)。结果表明,在以前的一些研究中,不恰当地使用准一级方法会产生对二级速率常数的有偏差的估计。在我们的研究中,这种误差表示为反应物浓度偏离每个氧化反应的化学计量比的程度(P/N)的函数。不恰当地使用准一级方法的误差与 P/N 比呈负相关,在以前的一些 TCE 氧化研究中,误差高达估计的二级速率常数的 25%。基于我们的结果,对于研究的其他挥发性有机化合物,也存在类似的关系。