Moita Maria-Luísa C J, Santos Ângela F S, Correia Miguel A B S S, Lampreia Isabel M S
Centro de Química Estrutural, Departamento de Química e Bioquímica, Faculdade de Ciências, Institute of Molecular Sciences, Universidade de Lisboa, 1749-016 Lisboa, Portugal.
Molecules. 2025 Mar 8;30(6):1213. doi: 10.3390/molecules30061213.
One of the most used methods for capturing acidic gases from the atmosphere is the use of amines that react with the acids and can later be recovered. The choice of amines that are most efficient in capturing has been the subject of several studies; however, the energy effort for their regeneration is also important. While the polarity of the solvent plays a critical role in determining which amines efficiently capture CO, the heat capacity of the solvent is also a significant factor in the regeneration process. In this work, we present values for Reichardt's ETN30 and Kamlet-Taft parameters, such as * (dipolarity/polarizability), (acidity), and (basicity), for solutions of two alkanolamines and two alkoxyamines dissolved in propane-1,3-diol, at 298.15 K, a solvent with a lower heat capacity than water. In addition to the polarity characterization of the amines in that solvent, the aim of this study is to analyze the differences observed in the solvatochromic parameters when water is replaced by alcohol. The impact of this change on the values of those parameters for the binary amine + solvent solutions was assessed by calculating the transfer values, ΔtransfFi,xi. Defined as, ΔtransfFi,xi=Fi1,3PD-FiH2O, these transfer values represent the difference in the parameters when the amines are transferred from water to alcohol. While the water medium is more favourable in terms of * for CO capture, the alcohol medium appears to hold more promise in terms of .
从大气中捕获酸性气体最常用的方法之一是使用能与酸反应且随后可回收的胺类物质。选择捕获效率最高的胺类物质一直是多项研究的主题;然而,其再生所需的能量消耗也很重要。虽然溶剂的极性在确定哪些胺类能有效捕获二氧化碳方面起着关键作用,但溶剂的热容在再生过程中也是一个重要因素。在这项工作中,我们给出了两种链烷醇胺和两种烷氧基胺溶解于1,3 - 丙二醇(一种热容比水低的溶剂)的溶液在298.15 K时的赖卡特ETN30值以及卡姆雷特 - 塔夫脱参数,如 *(偶极矩/极化率)、(酸度)和(碱度)。除了该溶剂中胺类的极性表征外,本研究的目的是分析用水替换醇时在溶剂化显色参数中观察到的差异。通过计算转移值ΔtransfFi,xi评估这种变化对二元胺 + 溶剂溶液中这些参数值的影响。这些转移值定义为ΔtransfFi,xi = Fi1,3PD - FiH2O,它们表示胺类从水转移到醇时参数的差异。虽然水介质在 * 方面对捕获二氧化碳更有利,但醇介质在方面似乎更有前景。