甲基环戊烷 + 乙酸乙酯)二元液体混合物的热力学行为:不同温度下的密度以及 25、50 和 101.3 kPa 下的气液平衡

IF 2 3区 工程技术 Q3 CHEMISTRY, MULTIDISCIPLINARY Journal of Chemical & Engineering Data Pub Date : 2024-03-19 DOI:10.1021/acs.jced.4c00013
Kaoutar Berkalou, Vincent Caqueret, Gabriela Zanghelini and Stéphane Vitu*, 
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引用次数: 0

摘要

本研究首次研究了甲基环戊烷 + 乙酸乙酯二元体系的密度和等压相平衡。在整个成分范围内,使用振动管密度计在 101 kPa(288.15 至 308.15 K)的条件下测量了该体系的密度。通过使用 Redlich-Kister 方程,观测到了正过量摩尔体积,并与之相关联。通过循环埃布尔计测量了甲基环戊烷 + 乙酸乙酯系统的新等压气液平衡数据。相平衡是在 25、50 和 101.3 千帕时测量的。通过对液相和冷凝气相的密度测定,间接确定了平衡成分。为了与之前公布的结果进行比较并验证实验方案,还对乙酸乙酯 + 甲基环己烷二元体系进行了一些额外的密度和汽液平衡数据测量。甲基环戊烷 + 乙酸乙酯二元混合物显示出明显的正偏离理想状态和正共沸物。采用了三种热力学一致性测试来验证所生成的数据集。报告的数据成功地与 NRTL 模型相关联,同时还使用了修改后的 UNIFAC 预测模型。UNIFAC 很好地描述了 101.3 kPa 时的相行为,而在低压(25 和 50 kPa)下的预测则不太准确。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

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Thermodynamic Behavior of the (Methylcyclopentane + Ethyl Acetate) Binary Liquid Mixture: Density at Several Temperatures and Vapor–Liquid Equilibrium at 25, 50, and 101.3 kPa

The density and isobaric phase equilibria of the binary system methylcyclopentane + ethyl acetate were investigated for the first time in this work. The density of the system was measured at 101 kPa from 288.15 to 308.15 K for the entire composition range thanks to a vibrating tube densimeter. Positive excess molar volumes were observed and correlated by using a Redlich–Kister equation. New isobaric vapor–liquid equilibrium data for the system methylcyclopentane + ethyl acetate were measured by means of a recirculation ebulliometer. The phase equilibrium was measured at 25, 50, and 101.3 kPa. Equilibrium compositions were determined indirectly from density measurements of the liquid and condensed vapor phases. Some additional density and vapor–liquid equilibrium data measurements for the binary system ethyl acetate + methylcyclohexane were performed for comparison with previously published results and validation of the experimental protocol. The methylcyclopentane + ethyl acetate binary mixture displays pronounced positive deviations from ideality and a positive azeotrope. Three thermodynamic consistency tests were employed to validate the produced data set. The reported data were successfully correlated by the NRTL model, and the modified UNIFAC predictive model was also used. UNIFAC provides a very good description of the phase behavior at 101.3 kPa, whereas predictions are less accurate at low pressures (25 and 50 kPa).

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来源期刊
Journal of Chemical & Engineering Data
Journal of Chemical & Engineering Data 工程技术-工程:化工
CiteScore
5.20
自引率
19.20%
发文量
324
审稿时长
2.2 months
期刊介绍: The Journal of Chemical & Engineering Data is a monthly journal devoted to the publication of data obtained from both experiment and computation, which are viewed as complementary. It is the only American Chemical Society journal primarily concerned with articles containing data on the phase behavior and the physical, thermodynamic, and transport properties of well-defined materials, including complex mixtures of known compositions. While environmental and biological samples are of interest, their compositions must be known and reproducible. As a result, adsorption on natural product materials does not generally fit within the scope of Journal of Chemical & Engineering Data.
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