A study on monoterpenoid-based natural deep eutectic solvents

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 develo...

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Detalles Bibliográficos
Autores: Rozas Azcona, Sara, Zamora Pastor, Lorena, Benito, Cristina, Atilhan, Mert, Aparicio Martínez, Santiago
Tipo de recurso: artículo
Estado:Versión publicada
Fecha de publicación:2023
País:España
Institución:Universidad de Burgos (UBU)
Repositorio:Repositorio Institucional de la Universidad de Burgos (RIUBU)
OAI Identifier:oai:riubu.ubu.es:10259/9495
Acceso en línea:http://hdl.handle.net/10259/9495
Access Level:acceso abierto
Palabra clave:Natural deep eutectic solvents
Terpenes
DFT
MD
COSMO-RS
CO2 solubility
Química física
Chemistry, Physical and theoretical
Descripción
Sumario: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.