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胆碱基离子液体在调节d-果糖溶液热物理性质中的作用。

The role of choline-based ionic liquids in modulating the thermophysical properties of d-fructose solutions.

作者信息

Dorosti Sara, Shekaari Hemayat, Bagheri Mohammad, Ghaffari Fariba, Mokhtarpour Masumeh

机构信息

Department of Physical Chemistry, Faculty of Chemistry, University of Tabriz, Tabriz, Iran.

出版信息

BMC Chem. 2025 Jun 5;19(1):160. doi: 10.1186/s13065-025-01491-5.

Abstract

In order to better understand how choline-based ionic liquids can improve the process of converting sugar to bioethanol, our study examined how d-fructose interacted with aqueous solutions of choline salicylate ([Ch][Sal]), choline formate ([Ch][For]), and choline acetate ([Ch][Ace]). A series of measurements including density, speed of sound, viscosity, and electrical conductivity were performed across varying temperatures and concentrations to assess the physicochemical performance of d-fructose in the studied solutions. The obtained properties including apparent molar volume (V), apparent molar isentropic compressibility (κ), viscosity B-coefficients, and molar conductivity (Λ) were analyzed to gain insights into the nature of intermolecular interactions. The calculated standard partial molar volume (V) of d-fructose indicated enhanced interactions between d-fructose and the ionic liquids. Hepler's constant values pointed to a structure-making tendency of d-fructose, particularly in aqueous [Ch][Sal] solutions. To further probe these interactions, DFT-COSMO calculation was employed, revealing that [Ch][Sal] exhibits preferentially the most energetically favorable interactions. Additionally, values of apparent specific volume (ASV) and apparent specific isentropic compressibility (ASIC) suggested that the ILs have a negligible influence on the inherent physical characteristics of d-fructose. As the temprature increased, the hydration number of d-fructose decreased, which can be due to the weakening of hydrogen bonding with water. These results highlight [Ch][Sal] ionic liquid as a promising medium for potentially promoting sugar-to-bioethanol conversion.

摘要

为了更好地理解胆碱基离子液体如何改善糖转化为生物乙醇的过程,我们的研究考察了d-果糖与水杨酸胆碱([Ch][Sal])、甲酸胆碱([Ch][For])和乙酸胆碱([Ch][Ace])水溶液之间的相互作用。在不同温度和浓度下进行了一系列测量,包括密度、声速、粘度和电导率,以评估d-果糖在所研究溶液中的物理化学性能。对获得的性质,包括表观摩尔体积(V)、表观摩尔等熵压缩系数(κ)、粘度B系数和摩尔电导率(Λ)进行了分析,以深入了解分子间相互作用的本质。计算得到的d-果糖的标准偏摩尔体积(V)表明d-果糖与离子液体之间的相互作用增强。赫普勒常数的值表明d-果糖具有结构形成倾向,特别是在[Ch][Sal]水溶液中。为了进一步探究这些相互作用,采用了DFT-COSMO计算,结果表明[Ch][Sal]表现出最有利的能量相互作用。此外,表观摩尔比容(ASV)和表观摩尔比等熵压缩系数(ASIC)的值表明离子液体对d-果糖的固有物理特性影响可忽略不计。随着温度升高,d-果糖的水合数减少,这可能是由于与水的氢键减弱所致。这些结果突出了[Ch][Sal]离子液体作为潜在促进糖向生物乙醇转化的有前景的介质。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1ebb/12142968/9c6b5bb3b7ff/13065_2025_1491_Fig1_HTML.jpg

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