J. V. Mattos, M. J. Molina, S. B. Rodriguez-Reartes, L. Ferreira-Pinto, M. S. Zabaloy, P. F. Arce, L. Cardozo-Filho
{"title":"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","authors":"J. V. Mattos, M. J. Molina, S. B. Rodriguez-Reartes, L. Ferreira-Pinto, M. S. Zabaloy, P. F. Arce, L. Cardozo-Filho","doi":"10.1134/S0036024424701929","DOIUrl":null,"url":null,"abstract":"<p>In this study, experimental carry out of liquid–vapor and solid–liquid phase transitions were conducted for the ternary system {CO<sub>2</sub> (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 {CO<sub>2</sub> (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 {CO<sub>2</sub> (1) + ethanol (2) + acetaminophen (3)} with a saturated solution at the lowest temperature, 313 K, CO<sub>2</sub> 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.</p>","PeriodicalId":767,"journal":{"name":"Russian Journal of Physical Chemistry A","volume":"98 12","pages":"2706 - 2716"},"PeriodicalIF":0.7000,"publicationDate":"2024-11-18","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Experimental Data and Thermodynamic Modeling of Solid–Liquid and Liquid–Vapor Equilibria in the CO2 + Ethanol + Acetaminophen System\",\"authors\":\"J. V. Mattos, M. J. Molina, S. B. Rodriguez-Reartes, L. Ferreira-Pinto, M. S. Zabaloy, P. F. Arce, L. Cardozo-Filho\",\"doi\":\"10.1134/S0036024424701929\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p>In this study, experimental carry out of liquid–vapor and solid–liquid phase transitions were conducted for the ternary system {CO<sub>2</sub> (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 {CO<sub>2</sub> (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 {CO<sub>2</sub> (1) + ethanol (2) + acetaminophen (3)} with a saturated solution at the lowest temperature, 313 K, CO<sub>2</sub> 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.</p>\",\"PeriodicalId\":767,\"journal\":{\"name\":\"Russian Journal of Physical Chemistry A\",\"volume\":\"98 12\",\"pages\":\"2706 - 2716\"},\"PeriodicalIF\":0.7000,\"publicationDate\":\"2024-11-18\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Russian Journal of Physical Chemistry A\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://link.springer.com/article/10.1134/S0036024424701929\",\"RegionNum\":4,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q4\",\"JCRName\":\"CHEMISTRY, PHYSICAL\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Russian Journal of Physical Chemistry A","FirstCategoryId":"92","ListUrlMain":"https://link.springer.com/article/10.1134/S0036024424701929","RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
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.
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.