二氧化碳+乙醇+对乙酰氨基酚体系中固液和液汽平衡的实验数据和热力学模型

IF 0.7 4区 化学 Q4 CHEMISTRY, PHYSICAL Russian Journal of Physical Chemistry A Pub Date : 2024-11-18 DOI:10.1134/S0036024424701929
J. V. Mattos, M. J. Molina, S. B. Rodriguez-Reartes, L. Ferreira-Pinto, M. S. Zabaloy, P. F. Arce, L. Cardozo-Filho
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引用次数: 0

摘要

本研究针对乙醇中不同浓度的扑热息痛在温度为 313 至 333 K、压力高达 12 MPa 的三元体系 {CO2 (1) + 乙醇 (2) + 对乙酰氨基酚 (3)} 进行了液-气相和固-液相转变实验。高压相变实验数据是在可变容积观察池中采用静态方法获得的。实验数据与文献中含有对乙酰氨基酚的饱和溶液体系进行了比较。在所研究的温度和浓度条件下,对乙酰氨基酚在二元体系 {CO2 (1) + 乙醇 (2)} 中的存在极大地改变了相的行为。研究观察到,在最低温度 313 K 饱和溶液的三元体系 {CO2 (1) + 乙醇 (2) + 对乙酰氨基酚 (3)} 中,二氧化碳在分子分数低于 0.6 时充当共溶剂。采用扰动链统计关联流体理论(PC-SAFT)状态方程(EoS)进行的热力学模拟与实验结果充分吻合。观察到的压力和温度的最小偏差验证了本研究中应用的热力学模型的有效性。
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Experimental Data and Thermodynamic Modeling of Solid–Liquid and Liquid–Vapor Equilibria in the CO2 + Ethanol + Acetaminophen System

In this study, experimental carry out of liquid–vapor and solid–liquid phase transitions were conducted for the ternary system {CO2 (1) + ethanol (2) + acetaminophen (3)} at different concentrations of paracetamol in ethanol for temperatures from 313 to 333 K and pressures up to 12 MPa. Experimental high pressure phase transition data were obtained using the static method in a variable volume view cell. Experimental data were compared with the literature for systems containing acetaminophen in a saturated solution. The presence of paracetamol in the binary system {CO2 (1) + ethanol (2)} significantly alters the behavior of the phase under the conditions of temperature and concentration studied. It was observed that in the ternary system {CO2 (1) + ethanol (2) + acetaminophen (3)} with a saturated solution at the lowest temperature, 313 K, CO2 acts as a cosolvent for mole fractions lower than 0.6. Thermodynamic simulations employing the Perturbed Chain Statistical Associating Fluid Theory (PC-SAFT) Equations of State (EoS) aligned the experimental results adequately. The observed minimal deviations in pressure and temperature validate the efficacy of the thermodynamic models applied in this study.

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来源期刊
CiteScore
1.20
自引率
14.30%
发文量
376
审稿时长
5.1 months
期刊介绍: Russian Journal of Physical Chemistry A. Focus on Chemistry (Zhurnal Fizicheskoi Khimii), founded in 1930, offers a comprehensive review of theoretical and experimental research from the Russian Academy of Sciences, leading research and academic centers from Russia and from all over the world. Articles are devoted to chemical thermodynamics and thermochemistry, biophysical chemistry, photochemistry and magnetochemistry, materials structure, quantum chemistry, physical chemistry of nanomaterials and solutions, surface phenomena and adsorption, and methods and techniques of physicochemical studies.
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