Viscosity and Density Measurement and Modeling in Methyl Levulinate and 1-Alkanol Mixtures

IF 2.9 4区 工程技术 Q3 CHEMISTRY, PHYSICAL International Journal of Thermophysics Pub Date : 2025-03-10 DOI:10.1007/s10765-025-03536-2
Mohammad Almasi, Mohammad Reza Mohebbifar
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Abstract

This study presents an investigation into the density and viscosity measurements of binary fluids composed of methyl levulinate (ML) and primary aliphatic alcohols (ranging from 1-butanol to 1-heptanol) across 293.15 K to 323.15 K. Using measurement techniques, the excess molar volumes and viscosity deviations were systematically analyzed, revealing that steric effects from the alcohol chains dominate over hydrogen-bonding interactions in these systems. The results demonstrate that longer alkyl chains significantly weaken intermolecular interactions, leading to increasingly negative viscosity deviations. To advance the state of the art in thermodynamic measurement and modeling, the PC-SAFT model was employed to predict mixture densities, achieving a high correlation to experimental density. The maximum deviation observed for the methyl levulinate + 1-pentanol system was only 0.94 %, underscoring the model’s reliability and practical utility for optimizing measurement-based applications. This work not only provides critical insights into the role of steric effects in complex liquid systems but also contributes to the development of measurement methodologies for thermophysical property analysis.

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乙酰丙酸甲酯和1-烷醇混合物的粘度和密度测量与建模
本文研究了由乙酰丙酸甲酯(ML)和伯脂肪醇(从1-丁醇到1-庚醇)组成的二元流体在293.15 K至323.15 K范围内的密度和粘度测量。利用测量技术,系统地分析了过量摩尔体积和粘度偏差,揭示了在这些体系中,醇链的位阻效应主导了氢键相互作用。结果表明,较长的烷基链显著削弱了分子间相互作用,导致负粘度偏差越来越大。为了提高热力学测量和建模的水平,采用PC-SAFT模型预测混合物密度,实现了与实验密度的高相关性。对乙酰丙酸甲酯+ 1-戊醇体系观察到的最大偏差仅为0.94%,强调了该模型在优化基于测量的应用中的可靠性和实用性。这项工作不仅为复杂液体系统中立体效应的作用提供了重要的见解,而且有助于热物理性质分析测量方法的发展。
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来源期刊
CiteScore
4.10
自引率
9.10%
发文量
179
审稿时长
5 months
期刊介绍: International Journal of Thermophysics serves as an international medium for the publication of papers in thermophysics, assisting both generators and users of thermophysical properties data. This distinguished journal publishes both experimental and theoretical papers on thermophysical properties of matter in the liquid, gaseous, and solid states (including soft matter, biofluids, and nano- and bio-materials), on instrumentation and techniques leading to their measurement, and on computer studies of model and related systems. Studies in all ranges of temperature, pressure, wavelength, and other relevant variables are included.
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