Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation

Equilibrium solubility of triclocarban (TCC) expressed in mole fraction in 1,4-dioxane and cyclohexane, as well, as in 19 {cyclohexane (1) + 1,4-dioxane (2)} mixtures, was determined at seven temperatures from T = (288.15 to 318.15) K. Logarithmic TCC solubility in these cosolvent mixtures was adequ...

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Autores:
Delgado, Daniel Ricardo
Tipo de recurso:
Article of journal
Fecha de publicación:
2022
Institución:
Universidad Cooperativa de Colombia
Repositorio:
Repositorio UCC
Idioma:
eng
OAI Identifier:
oai:repository.ucc.edu.co:20.500.12494/55525
Acceso en línea:
https://hdl.handle.net/20.500.12494/55525
Palabra clave:
Triclocarban
Solibility
Rights
openAccess
License
http://creativecommons.org/licenses/by/4.0/
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dc.title.none.fl_str_mv Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation
dc.title.translated.none.fl_str_mv Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation
title Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation
spellingShingle Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation
Triclocarban
Solibility
title_short Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation
title_full Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation
title_fullStr Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation
title_full_unstemmed Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation
title_sort Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation
dc.creator.fl_str_mv Delgado, Daniel Ricardo
dc.contributor.author.none.fl_str_mv Delgado, Daniel Ricardo
dc.contributor.researchgroup.none.fl_str_mv Grupo de Investigación de Ingenierías UCC-Neiva
dc.subject.proposal.none.fl_str_mv Triclocarban
Solibility
topic Triclocarban
Solibility
description Equilibrium solubility of triclocarban (TCC) expressed in mole fraction in 1,4-dioxane and cyclohexane, as well, as in 19 {cyclohexane (1) + 1,4-dioxane (2)} mixtures, was determined at seven temperatures from T = (288.15 to 318.15) K. Logarithmic TCC solubility in these cosolvent mixtures was adequately correlated with a lineal bivariate equation as function of both the mixtures composition and temperature. Apparent thermodynamic quantities for the dissolution and mixing processes were computed by means of the van’t Hoff and Gibbs equations observing endothermal and entropy-driven dissolution processes in all cases. The enthalpy–entropy compensation plot of apparent enthalpy vs. apparent Gibbs energy was linear exhibiting positive slope implying enthalpy-driving for TCC transfer from cyclohexane to 1,4-dioxane. Ultimately, by using the inverse Kirkwood–Buff integrals it is observed that TCC is preferentially solvated by cyclohexane molecules in 1,4-dioxane-rich mixtures but preferentially solvated by 1,4-dioxane molecules in cyclohexane-rich mixtures.
publishDate 2022
dc.date.issued.none.fl_str_mv 2022-10-11
dc.date.accessioned.none.fl_str_mv 2024-05-06T20:42:04Z
dc.date.available.none.fl_str_mv 2024-05-06T20:42:04Z
dc.type.none.fl_str_mv Artículo de revista
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dc.identifier.citation.none.fl_str_mv Agredo-Collazos, J.J., Ortiz, C.P., Cerquera, N.E. et al. Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation. J Solution Chem 51, 1603–1625 (2022). https://doi.org/10.1007/s10953-022-01209-4
dc.identifier.issn.none.fl_str_mv 1572-8927
dc.identifier.uri.none.fl_str_mv https://hdl.handle.net/20.500.12494/55525
dc.identifier.doi.none.fl_str_mv doi.org/10.1007/s10953-022-01209-4
dc.identifier.eissn.none.fl_str_mv 0095-9782
identifier_str_mv Agredo-Collazos, J.J., Ortiz, C.P., Cerquera, N.E. et al. Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation. J Solution Chem 51, 1603–1625 (2022). https://doi.org/10.1007/s10953-022-01209-4
1572-8927
doi.org/10.1007/s10953-022-01209-4
0095-9782
url https://hdl.handle.net/20.500.12494/55525
dc.language.iso.none.fl_str_mv eng
language eng
dc.relation.citationendpage.none.fl_str_mv 1625
dc.relation.citationstartpage.none.fl_str_mv 1603
dc.relation.citationvolume.none.fl_str_mv 51
dc.relation.ispartofjournal.none.fl_str_mv Journal of Solution Chemistry
dc.relation.references.none.fl_str_mv Budavari, S., O’Neil, M.J., Smith, A., Heckelman, P.E., Obenchain, J.R., Jr., Gallipeau, J.A.R., D’Arecea, M.A.: The Merck Index: An Encyclopedia of Chemicals, Drugs, and Biologicals, 13th edn. Merck & Co., Inc., Whitehouse Station, NJ (2001)
Khan, R., Zeb, A., Roy, N., Magar, R.T., Kim, H.J., Lee, K.W., Lee, S.-W.: Biochemical and structural basis of triclosan resistance in a novel enoyl-acyl carrier protein reductase. Antimicrob. Agents Chemother. 62, e00648-e718 (2018)
Zhu, L., Bi, H., Ma, J., Hu, Z., Zhang, W., Cronan, J.E., Wang, H.: The two functional enoylacyl carrier protein reductases of enterococcus faecalis do not mediate triclosan resistance. MBio 4, e00613 (2013)
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dc.publisher.none.fl_str_mv Universidad Cooperativa de Colombia, Facultad de Ingenierías, Ingeniería Civil, Neiva
dc.publisher.place.none.fl_str_mv Neiva
publisher.none.fl_str_mv Universidad Cooperativa de Colombia, Facultad de Ingenierías, Ingeniería Civil, Neiva
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spelling Delgado, Daniel RicardoGrupo de Investigación de Ingenierías UCC-Neiva2024-05-06T20:42:04Z2024-05-06T20:42:04Z2022-10-11Agredo-Collazos, J.J., Ortiz, C.P., Cerquera, N.E. et al. Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential Solvation. J Solution Chem 51, 1603–1625 (2022). https://doi.org/10.1007/s10953-022-01209-41572-8927https://hdl.handle.net/20.500.12494/55525doi.org/10.1007/s10953-022-01209-40095-9782Equilibrium solubility of triclocarban (TCC) expressed in mole fraction in 1,4-dioxane and cyclohexane, as well, as in 19 {cyclohexane (1) + 1,4-dioxane (2)} mixtures, was determined at seven temperatures from T = (288.15 to 318.15) K. Logarithmic TCC solubility in these cosolvent mixtures was adequately correlated with a lineal bivariate equation as function of both the mixtures composition and temperature. Apparent thermodynamic quantities for the dissolution and mixing processes were computed by means of the van’t Hoff and Gibbs equations observing endothermal and entropy-driven dissolution processes in all cases. The enthalpy–entropy compensation plot of apparent enthalpy vs. apparent Gibbs energy was linear exhibiting positive slope implying enthalpy-driving for TCC transfer from cyclohexane to 1,4-dioxane. Ultimately, by using the inverse Kirkwood–Buff integrals it is observed that TCC is preferentially solvated by cyclohexane molecules in 1,4-dioxane-rich mixtures but preferentially solvated by 1,4-dioxane molecules in cyclohexane-rich mixtures.Energias, agua y medio ambientepdfapplication/pdfengUniversidad Cooperativa de Colombia, Facultad de Ingenierías, Ingeniería Civil, NeivaNeivahttp://creativecommons.org/licenses/by/4.0/info:eu-repo/semantics/openAccessAttribution 4.0 Internationalhttp://purl.org/coar/access_right/c_abf2https://link.springer.com/article/10.1007/s10953-022-01209-4Equilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential SolvationEquilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures: Determination, Correlation, Thermodynamics and Preferential SolvationArtículo de revistahttp://purl.org/coar/resource_type/c_6501http://purl.org/coar/resource_type/c_2df8fbb1http://purl.org/coar/version/c_970fb48d4fbd8a85info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersion1625160351Journal of Solution ChemistryBudavari, S., O’Neil, M.J., Smith, A., Heckelman, P.E., Obenchain, J.R., Jr., Gallipeau, J.A.R., D’Arecea, M.A.: The Merck Index: An Encyclopedia of Chemicals, Drugs, and Biologicals, 13th edn. Merck & Co., Inc., Whitehouse Station, NJ (2001)Khan, R., Zeb, A., Roy, N., Magar, R.T., Kim, H.J., Lee, K.W., Lee, S.-W.: Biochemical and structural basis of triclosan resistance in a novel enoyl-acyl carrier protein reductase. Antimicrob. Agents Chemother. 62, e00648-e718 (2018)Zhu, L., Bi, H., Ma, J., Hu, Z., Zhang, W., Cronan, J.E., Wang, H.: The two functional enoylacyl carrier protein reductases of enterococcus faecalis do not mediate triclosan resistance. MBio 4, e00613 (2013)TriclocarbanSolibilityPublication3171Estudio termodinámico de la solubilidad de la isoniacida en sistemas acuosos polietilenglicol 200, 300, 400 y 600 e implementación de algoritmos de machine learning para la predicción de la solubilidad.ORIGINALEquilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures Determination, Correlation, Thermodynamics and Preferential Solvation.pdfEquilibrium Solubility of Triclocarban in (Cyclohexane + 1,4-Dioxane) Mixtures Determination, Correlation, Thermodynamics and Preferential Solvation.pdfapplication/pdf2043522https://repository.ucc.edu.co/bitstreams/52bf45cd-dd53-4f11-9d5c-dd8770200101/download5f4cd321040f935bdadabae57b73285bMD51CC-LICENSElicense_rdflicense_rdfapplication/rdf+xml; charset=utf-8908https://repository.ucc.edu.co/bitstreams/f282e2a6-be88-4617-a7c5-8defa44cdf52/download0175ea4a2d4caec4bbcc37e300941108MD52LICENSElicense.txtlicense.txttext/plain; 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