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Thermodynamic Behavior of (2-Propanol + 1,8-Cineole) Mixtures: Isothermal Vapor-Liquid Equilibria, Densities, Enthalpies of Mixing, and Modeling

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논문

Thermodynamic Behavior of (2-Propanol + 1,8-Cineole) Mixtures: Isothermal Vapor-Liquid Equilibria, Densities, Enthalpies of Mixing, and Modeling

학술지

International journal of molecular sciences

저자명

Gimeno, Beatriz; Martinez, Santiago; Mainar, Ana M.; Urieta, Jose S.; Perez, Pascual

초록

<P>Vapor pressures and other thermodynamic properties of liquids, such as density and enthalpy of mixtures, are the key parameters in chemical engineering for designing new process units, and are also essential for understanding the physical chemistry, macroscopic and molecular behavior of fluid systems. In this work, vapor pressures between 278.15 and 323.15 K, densities and enthalpies of mixtures between 288.15 and 318.15 K for the binary mixture (2-propanol + 1,8-cineole) have been measured. From the vapor pressure data, activity coefficients and excess Gibbs energies were calculated via the Barker&rsquo;s method and the Wilson equation. Excess molar volumes and excess molar enthalpies were also obtained from the density and calorimetric measurements. Thermodynamic consistency test between excess molar Gibbs energies and excess molar enthalpies has been carried out using the Gibbs&#x2013;Helmholtz equation. Robinson&#x2013;Mathias, and Peng&#x2013;Robinson&#x2013;Stryjek&#x2013;Vera together with volume translation of Peneloux equations of state (EoS) are considered, as well as the statistical associating fluid theory that offers a molecular vision quite suitable for systems having highly non-spherical or associated molecules. Of these three models, the first two fit the experimental vapor pressure results quite adequately; in contrast, only the last one approaches the volumetric behavior of the system. A brief comparison of the thermodynamic excess molar functions for binary mixtures of short-chain alcohol + 1,8-cineole (cyclic ether), or +di-n-propylether (lineal ether) is also included.</P>

발행연도

2023

발행기관

MDPI

ISSN

1661-6596

ISSN

1422-0067

24

12

페이지

pp.10380

주제어

1,8-cineole; 2-propanol; vapor pressure; phase equilibria; excess thermodynamic functions; PRM; PRSV EoS; volume translation; SAFT

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1 2023-12-11

논문; 2023-06-20

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