Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K

Methyl, ethyl and propyl parabens equilibrium solubility was determined in (methanol + water) binary mixtures at 298.15 K. The mole fraction solubility of these compounds increased in 503 (from 2.40 × 10-4to 0.121), 1377 (from 9.86 × 10-5to 0.136) and 4597 (from 3.73 × 10-5to 0.171) times when passi...

Full description

Autores:
Cárdenas Z.J.
Jiménez D.M.
Delgado, Daniel Ricardo
Almanza O.A.
Jouyban A.
Martínez F.
Acree W.E.
Jr.
Tipo de recurso:
Article of journal
Fecha de publicación:
2017
Institución:
Universidad Cooperativa de Colombia
Repositorio:
Repositorio UCC
Idioma:
OAI Identifier:
oai:repository.ucc.edu.co:20.500.12494/41487
Acceso en línea:
https://doi.org/10.1016/j.rcp.2016.02.001
https://hdl.handle.net/20.500.12494/41487
Palabra clave:
Inverse Kirkwood-Buff integrals
Jouyban-Acree mode
lMethanol + water mixtures
Parabens
Preferential solvation
Solubility
Rights
closedAccess
License
http://purl.org/coar/access_right/c_14cb
id COOPER2_19daa93abfb5d15e3cf9174759e3cb5b
oai_identifier_str oai:repository.ucc.edu.co:20.500.12494/41487
network_acronym_str COOPER2
network_name_str Repositorio UCC
repository_id_str
spelling Cárdenas Z.J.Jiménez D.M.Delgado, Daniel RicardoAlmanza O.A.Jouyban A.Martínez F.Acree W.E.Jr.2021-12-16T22:15:33Z2021-12-16T22:15:33Z2017https://doi.org/10.1016/j.rcp.2016.02.00100219614https://hdl.handle.net/20.500.12494/41487Cárdenas ZJ,Jiménez DM,Delgado DR,Almanza OA,Jouyban A,Martínez F,Acree WE,JR. Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K. J CHEM THERMODYN. 2017. 108. p. 26-37. .Methyl, ethyl and propyl parabens equilibrium solubility was determined in (methanol + water) binary mixtures at 298.15 K. The mole fraction solubility of these compounds increased in 503 (from 2.40 × 10-4to 0.121), 1377 (from 9.86 × 10-5to 0.136) and 4597 (from 3.73 × 10-5to 0.171) times when passing from neat water to neat methanol, for methyl, ethyl and propyl parabens, respectively. All these solubility values were correlated with the Jouyban-Acree model. Preferential solvation parameters by methanol (dx1,3) of these parabens were derived from their thermodynamic solution properties using the inverse Kirkwood-Buff integrals (IKBI) method. For all compounds dx1,3values are negative in water-rich mixtures but positive in mixtures with methanol mole fraction greater than 0.32. It is conjecturable that in the former case the hydrophobic hydration around non-polar groups of parabens plays a relevant role in the solvation. Besides, the preferential solvation of these solutes by methanol in mixtures of similar co-solvent compositions and in methanol-rich mixtures could be explained in terms of the higher basic behaviour of methanol. © 2017 Elsevier Ltd0000-0002-4835-9739danielr.delgado@campusucc.edu.co37-26Academic PressInverse Kirkwood-Buff integralsJouyban-Acree modelMethanol + water mixturesParabensPreferential solvationSolubilitySolubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 KArtículohttp://purl.org/coar/resource_type/c_6501http://purl.org/coar/resource_type/c_2df8fbb1http://purl.org/coar/version/c_970fb48d4fbd8a85info:eu-repo/semantics/articlehttp://purl.org/redcol/resource_type/ARTinfo:eu-repo/semantics/publishedVersionJ CHEM THERMODYNinfo:eu-repo/semantics/closedAccesshttp://purl.org/coar/access_right/c_14cbPublication20.500.12494/41487oai:repository.ucc.edu.co:20.500.12494/414872024-08-20 16:22:01.592metadata.onlyhttps://repository.ucc.edu.coRepositorio Institucional Universidad Cooperativa de Colombiabdigital@metabiblioteca.com
dc.title.spa.fl_str_mv Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K
title Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K
spellingShingle Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K
Inverse Kirkwood-Buff integrals
Jouyban-Acree mode
lMethanol + water mixtures
Parabens
Preferential solvation
Solubility
title_short Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K
title_full Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K
title_fullStr Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K
title_full_unstemmed Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K
title_sort Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K
dc.creator.fl_str_mv Cárdenas Z.J.
Jiménez D.M.
Delgado, Daniel Ricardo
Almanza O.A.
Jouyban A.
Martínez F.
Acree W.E.
Jr.
dc.contributor.author.none.fl_str_mv Cárdenas Z.J.
Jiménez D.M.
Delgado, Daniel Ricardo
Almanza O.A.
Jouyban A.
Martínez F.
Acree W.E.
Jr.
dc.subject.spa.fl_str_mv Inverse Kirkwood-Buff integrals
Jouyban-Acree mode
lMethanol + water mixtures
Parabens
Preferential solvation
Solubility
topic Inverse Kirkwood-Buff integrals
Jouyban-Acree mode
lMethanol + water mixtures
Parabens
Preferential solvation
Solubility
description Methyl, ethyl and propyl parabens equilibrium solubility was determined in (methanol + water) binary mixtures at 298.15 K. The mole fraction solubility of these compounds increased in 503 (from 2.40 × 10-4to 0.121), 1377 (from 9.86 × 10-5to 0.136) and 4597 (from 3.73 × 10-5to 0.171) times when passing from neat water to neat methanol, for methyl, ethyl and propyl parabens, respectively. All these solubility values were correlated with the Jouyban-Acree model. Preferential solvation parameters by methanol (dx1,3) of these parabens were derived from their thermodynamic solution properties using the inverse Kirkwood-Buff integrals (IKBI) method. For all compounds dx1,3values are negative in water-rich mixtures but positive in mixtures with methanol mole fraction greater than 0.32. It is conjecturable that in the former case the hydrophobic hydration around non-polar groups of parabens plays a relevant role in the solvation. Besides, the preferential solvation of these solutes by methanol in mixtures of similar co-solvent compositions and in methanol-rich mixtures could be explained in terms of the higher basic behaviour of methanol. © 2017 Elsevier Ltd
publishDate 2017
dc.date.issued.none.fl_str_mv 2017
dc.date.accessioned.none.fl_str_mv 2021-12-16T22:15:33Z
dc.date.available.none.fl_str_mv 2021-12-16T22:15:33Z
dc.type.none.fl_str_mv Artículo
dc.type.coar.fl_str_mv http://purl.org/coar/resource_type/c_2df8fbb1
dc.type.coar.none.fl_str_mv http://purl.org/coar/resource_type/c_6501
dc.type.coarversion.none.fl_str_mv http://purl.org/coar/version/c_970fb48d4fbd8a85
dc.type.driver.none.fl_str_mv info:eu-repo/semantics/article
dc.type.redcol.none.fl_str_mv http://purl.org/redcol/resource_type/ART
dc.type.version.none.fl_str_mv info:eu-repo/semantics/publishedVersion
format http://purl.org/coar/resource_type/c_6501
status_str publishedVersion
dc.identifier.none.fl_str_mv https://doi.org/10.1016/j.rcp.2016.02.001
dc.identifier.issn.spa.fl_str_mv 00219614
dc.identifier.uri.none.fl_str_mv https://hdl.handle.net/20.500.12494/41487
dc.identifier.bibliographicCitation.spa.fl_str_mv Cárdenas ZJ,Jiménez DM,Delgado DR,Almanza OA,Jouyban A,Martínez F,Acree WE,JR. Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K. J CHEM THERMODYN. 2017. 108. p. 26-37. .
url https://doi.org/10.1016/j.rcp.2016.02.001
https://hdl.handle.net/20.500.12494/41487
identifier_str_mv 00219614
Cárdenas ZJ,Jiménez DM,Delgado DR,Almanza OA,Jouyban A,Martínez F,Acree WE,JR. Solubility and preferential solvation of some n-alkyl-parabens in methanol + water mixtures at 298.15 K. J CHEM THERMODYN. 2017. 108. p. 26-37. .
dc.relation.ispartofjournal.spa.fl_str_mv J CHEM THERMODYN
dc.rights.accessrights.none.fl_str_mv info:eu-repo/semantics/closedAccess
dc.rights.coar.none.fl_str_mv http://purl.org/coar/access_right/c_14cb
eu_rights_str_mv closedAccess
rights_invalid_str_mv http://purl.org/coar/access_right/c_14cb
dc.format.extent.spa.fl_str_mv 37-26
dc.publisher.spa.fl_str_mv Academic Press
institution Universidad Cooperativa de Colombia
repository.name.fl_str_mv Repositorio Institucional Universidad Cooperativa de Colombia
repository.mail.fl_str_mv bdigital@metabiblioteca.com
_version_ 1808789320569454592