A study on monoterpenoid-based natural deep eutectic solvents

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外文摘要：Herein,the synthesis and characterization methods of natural deep eutectic solvents based on monoterpenoids have been presented.Low viscous fluids with suitable physicochemical properties are produced.The materials are non-toxic,biodegradable,and cost-effective.Thus,they can be used to develop sustainable solvents for various processes and can find their applications in various fields.A theoretical study based on quantum chemistry and classical molecular dynamics is used for the nanoscopic characterization of structure,dynamics,and hydrogen bonding.The reported results help analyze the properties of this new family of solvents.The required information for developing structure-property relationships for proper solvent design to form a sustainable chemistry framework is obtained.

外文关键词：

Natural deep eutectic solventsTerpenesDFTMDCOSMO-RSCO2 solubility

作者：

Sara Rozas、Lorena Zamora、Cristina Benito、Mert Atilhan、Santiago Aparicio

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作者单位：

Department of Chemistry,University of Burgos,Burgos,09001,Spain

Department of Chemical and Paper Engineering,Western Michigan University,Kalamazoo,MI,49008-5462,USA

基金：

Junta de Castilla y LeonJunta de Castilla y LeonMinisterio de Ciencia,Innovación y UniversidadesMinisterio de Ciencia,Innovación y Universidades

项目编号：

Spainproject NANOCOMP-BU058P20Spainproject RTI2018-101987-B-I00

出版年：

2023

绿色化学工程(英文)

中国科学院过程工程研究所

绿色化学工程(英文)

CSCD

ISSN：

年,卷(期)：2023.4(1)

参考文献量96