Measurement and prediction of excess molar enthalpies of ternary mixtures involving ether with 1-alkanol and n-alkane

dc.contributor.affiliationUniversidade de Santiago de Compostela. Departamento de Física Aplicada
dc.contributor.authorVázquez Verdes, Pedro
dc.contributor.authorVijande, Javier
dc.contributor.authorMato, Marta M.
dc.contributor.authorLegido, José Luis
dc.contributor.authorPaz Andrade, M. I.
dc.date.accessioned2025-04-22T11:15:05Z
dc.date.available2025-04-22T11:15:05Z
dc.date.issued2024-06-24
dc.description.abstractThis work aims to experimentally determine the excess molar enthalpies at 298.15 K and atmospheric pressure for the ternary mixture {x1 methyl tert-butyl ether (MTBE) + x2 1-pentanol + (1 − x1 − x2) heptane} and the corresponding binary system {x 1-pentanol + (1 − x) heptane}, across the whole composition range. The excess molar enthalpy of the ternary system is positive throughout the composition range. Except for a region around compositions rich in 1-pentanol, the ternary contribution to the excess molar enthalpy is also positive and its representation is asymmetric. A systematic review of the currently accessible literature on excess molar enthalpy for the ternary mixtures containing ethers with 1-alkanol and 1-alkane was conducted. According to our searches, no previous experimental measurements of excess enthalpy for the ternary combination under study have been reported. The ternary excess enthalpy values and the involved binary mixtures were estimated using the UNIFAC group contribution model. Furthermore, several empirical equations for estimating ternary properties from binary results were tested against the experimental data to evaluate their predictive accuracy for ternary properties.
dc.description.peerreviewedSI
dc.description.sponsorshipXunta de Galicia [XUGA ED431C 2020/06V055]
dc.identifier.citationJournal of Molecular Liquids Volume 408, 15 August 2024, 125323
dc.identifier.doi10.1016/j.molliq.2024.125323
dc.identifier.essn1873-3166
dc.identifier.urihttps://hdl.handle.net/10347/40920
dc.issue.number125323
dc.journal.titleJournal of Molecular Liquids
dc.language.isoeng
dc.publisherElsevier
dc.relation.publisherversionhttps://doi.org/10.1016/j.molliq.2024.125323
dc.rights© 2024 The Author(s). Published by Elsevier B.V. This is an open access article under the CC BY-NC-ND license
dc.rightsAttribution-NonCommercial-NoDerivatives 4.0 Internationalen
dc.rights.accessRightsopen access
dc.rights.urihttp://creativecommons.org/licenses/by-nc-nd/4.0/
dc.subject1-Pentanol
dc.subjectExcess molar enthalpies
dc.subjectHeptane
dc.subjectMTBE
dc.subjectTernary mixture
dc.subjectUNIFAC Model
dc.titleMeasurement and prediction of excess molar enthalpies of ternary mixtures involving ether with 1-alkanol and n-alkane
dc.typejournal article
dc.type.hasVersionVoR
dc.volume.number408
dspace.entity.typePublication
relation.isAuthorOfPublication4a36c5a1-ebc1-4728-bca4-392ac7214fd0
relation.isAuthorOfPublication.latestForDiscovery4a36c5a1-ebc1-4728-bca4-392ac7214fd0

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