Institute for Biological Interfaces (IBG 1), Karlsruhe Institute of Technology (KIT), Hermann-von-Helmholtz-Platz 1, 76344, Karlsruhe, Germany.
Institute of Biochemistry and Technical Biochemistry, University of Stuttgart, Allmandring 31, 70569, Stuttgart, Germany.
Sci Rep. 2020 Dec 7;10(1):21395. doi: 10.1038/s41598-020-78101-y.
Deep eutectic solvents (DES) formed by quaternary ammonium salts and hydrogen bond donors are a promising green alternative to organic solvents. Their high viscosity at ambient temperatures can limit biocatalytic applications and therefore requires fine-tuning by adjusting water content and temperature. Here, we performed a meta-analysis of the impact of water content and temperature on the viscosities of four deep eutectic solvents (glyceline, reline, N,N-diethylethanol ammonium chloride-glycerol, N,N-diethylethanol ammonium chloride-ethylene glycol), their components (choline chloride, urea, glycerol, ethylene glycol), methanol, and pure water. We analyzed the viscosity data by an automated workflow, using Arrhenius and Vogel-Fulcher-Tammann-Hesse models. The consistency and completeness of experimental data and metadata was used as an essential criterion of data quality. We found that viscosities were reported for different temperature ranges, half the time without specifying a method of desiccation, and in almost half of the reports without specifying experimental errors. We found that the viscosity of the pure components varied widely, but that all aqueous mixtures (except for reline) have similar excess activation energy of viscous flow [Formula: see text]= 3-5 kJ/mol, whereas reline had a negative excess activation energy ([Formula: see text]= - 19 kJ/mol). The data and workflows used are accessible at https://doi.org/10.15490/FAIRDOMHUB.1.STUDY.767.1 .
由季铵盐和氢键供体形成的深共晶溶剂 (DES) 是替代有机溶剂的有前途的绿色替代品。它们在环境温度下的高粘度可能会限制生物催化应用,因此需要通过调整水含量和温度来进行微调。在这里,我们对水含量和温度对四种深共晶溶剂(甘油亚氨酸,雷林,N,N-二乙基乙醇铵氯化物-甘油,N,N-二乙基乙醇铵氯化物-乙二醇)及其成分(氯化胆碱,尿素,甘油,乙二醇),甲醇和纯水的粘度的影响进行了荟萃分析。我们使用 Arrhenius 和 Vogel-Fulcher-Tammann-Hesse 模型通过自动化工作流程分析了粘度数据。实验数据和元数据的一致性和完整性是数据质量的重要标准。我们发现,不同的温度范围报告了粘度,一半的时间没有指定干燥方法,几乎一半的报告没有指定实验误差。我们发现,纯组分的粘度差异很大,但所有水混合物(除了雷林)都具有相似的粘性流动过剩活化能 [公式:见文本] = 3-5 kJ/mol,而雷林的过剩活化能为负 [公式:见文本] = -19 kJ/mol。可在 https://doi.org/10.15490/FAIRDOMHUB.1.STUDY.767.1 处获得数据和工作流程。