Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data

Bibliographic Details
Main Author: Castello, Heloisa Froehlick [UNESP]
Publication Date: 2024
Other Authors: Silva, Felipe Lopes Rodrigues, Ferreira, Dennis Silva, Levada, Alexandre Luis Magalhães, Pereira-Filho, Edenir Rodrigues, Manhas Verbi Pereira, Fabiola [UNESP]
Format: Article
Language: eng
Source: Repositório Institucional da UNESP
Download full: http://dx.doi.org/10.1002/cem.3575
https://hdl.handle.net/11449/298179
Summary: This study discusses potential toxic elements detection in conventional nail polish, including Cr and Pb. The noteworthy results highlight well-established potential risks of elevated Cr and Pb concentrations. These elements are not allowed in the European Union. Implementing the minimum spanning tree (MST) approach and the isolation forest algorithm effectively clustered samples. Forty-five samples were analyzed, and four clusters were identified. Two presented six samples with high concentrations of Fe (Cluster 1 with four samples) and Cr and Pb (Cluster 2 with two samples). The other 39 samples presented low concentrations of the determined elements (Co, Cr, Cu, Fe, Ni, and Pb). Cadmium, Zn, and Mn were not detected in any of the analyzed samples. Furthermore, integrating energy-dispersive x-ray fluorescence (ED-XRF) and laser-induced breakdown spectroscopy (LIBS) enabled fast direct analysis of nail polish samples, streamlining a swift and reliable data acquisition process. This research underscores the importance of ongoing vigilance and monitoring of potential health hazards associated with nail polish formulations, especially in regions with regulatory restrictions on certain elements.
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spelling Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical DatachemometricsclusterED-XRFhealthLIBStoxic elementsThis study discusses potential toxic elements detection in conventional nail polish, including Cr and Pb. The noteworthy results highlight well-established potential risks of elevated Cr and Pb concentrations. These elements are not allowed in the European Union. Implementing the minimum spanning tree (MST) approach and the isolation forest algorithm effectively clustered samples. Forty-five samples were analyzed, and four clusters were identified. Two presented six samples with high concentrations of Fe (Cluster 1 with four samples) and Cr and Pb (Cluster 2 with two samples). The other 39 samples presented low concentrations of the determined elements (Co, Cr, Cu, Fe, Ni, and Pb). Cadmium, Zn, and Mn were not detected in any of the analyzed samples. Furthermore, integrating energy-dispersive x-ray fluorescence (ED-XRF) and laser-induced breakdown spectroscopy (LIBS) enabled fast direct analysis of nail polish samples, streamlining a swift and reliable data acquisition process. This research underscores the importance of ongoing vigilance and monitoring of potential health hazards associated with nail polish formulations, especially in regions with regulatory restrictions on certain elements.Conselho Nacional de Desenvolvimento Científico e Tecnológico (CNPq)Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)Group of Alternative Analytical Approaches (GAAA) Bioenergy Research Institute (IPBEN) Institute of Chemistry São Paulo State University (UNESP), São Paulo StateDepartment of Analytical Chemistry Physical Chemistry and Inorganic National Institute of Alternative Technologies for Detection Toxicological Assessment and Removal of Micropollutants and Radioactive Substances (INCT-DATREM), São Paulo StateGroup of Applied Instrumental Analysis Chemistry Department Federal University of São Carlos, São Paulo StateComputing Department Federal University of São Carlos, São Paulo StateGroup of Alternative Analytical Approaches (GAAA) Bioenergy Research Institute (IPBEN) Institute of Chemistry São Paulo State University (UNESP), São Paulo StateCNPq: 124833/2023-3CNPq: 140867/2021-0CNPq: 302085/2022-0CNPq: 302719/2020-2CNPq: 465571/2014-0CAPES: 88887136426/2017/00CAPES: Finance Code 001Universidade Estadual Paulista (UNESP)National Institute of Alternative Technologies for Detection Toxicological Assessment and Removal of Micropollutants and Radioactive Substances (INCT-DATREM)Universidade Federal de São Carlos (UFSCar)Castello, Heloisa Froehlick [UNESP]Silva, Felipe Lopes RodriguesFerreira, Dennis SilvaLevada, Alexandre Luis MagalhãesPereira-Filho, Edenir RodriguesManhas Verbi Pereira, Fabiola [UNESP]2025-04-29T18:36:23Z2024-09-01info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articlehttp://dx.doi.org/10.1002/cem.3575Journal of Chemometrics, v. 38, n. 9, 2024.1099-128X0886-9383https://hdl.handle.net/11449/29817910.1002/cem.35752-s2.0-85196618304Scopusreponame:Repositório Institucional da UNESPinstname:Universidade Estadual Paulista (UNESP)instacron:UNESPengJournal of Chemometricsinfo:eu-repo/semantics/openAccess2025-05-28T08:00:24Zoai:repositorio.unesp.br:11449/298179Repositório InstitucionalPUBhttp://repositorio.unesp.br/oai/requestrepositoriounesp@unesp.bropendoar:29462025-05-28T08:00:24Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP)false
dc.title.none.fl_str_mv Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data
title Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data
spellingShingle Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data
Castello, Heloisa Froehlick [UNESP]
chemometrics
cluster
ED-XRF
health
LIBS
toxic elements
title_short Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data
title_full Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data
title_fullStr Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data
title_full_unstemmed Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data
title_sort Minimum Spanning Tree-Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data
author Castello, Heloisa Froehlick [UNESP]
author_facet Castello, Heloisa Froehlick [UNESP]
Silva, Felipe Lopes Rodrigues
Ferreira, Dennis Silva
Levada, Alexandre Luis Magalhães
Pereira-Filho, Edenir Rodrigues
Manhas Verbi Pereira, Fabiola [UNESP]
author_role author
author2 Silva, Felipe Lopes Rodrigues
Ferreira, Dennis Silva
Levada, Alexandre Luis Magalhães
Pereira-Filho, Edenir Rodrigues
Manhas Verbi Pereira, Fabiola [UNESP]
author2_role author
author
author
author
author
dc.contributor.none.fl_str_mv Universidade Estadual Paulista (UNESP)
National Institute of Alternative Technologies for Detection Toxicological Assessment and Removal of Micropollutants and Radioactive Substances (INCT-DATREM)
Universidade Federal de São Carlos (UFSCar)
dc.contributor.author.fl_str_mv Castello, Heloisa Froehlick [UNESP]
Silva, Felipe Lopes Rodrigues
Ferreira, Dennis Silva
Levada, Alexandre Luis Magalhães
Pereira-Filho, Edenir Rodrigues
Manhas Verbi Pereira, Fabiola [UNESP]
dc.subject.por.fl_str_mv chemometrics
cluster
ED-XRF
health
LIBS
toxic elements
topic chemometrics
cluster
ED-XRF
health
LIBS
toxic elements
description This study discusses potential toxic elements detection in conventional nail polish, including Cr and Pb. The noteworthy results highlight well-established potential risks of elevated Cr and Pb concentrations. These elements are not allowed in the European Union. Implementing the minimum spanning tree (MST) approach and the isolation forest algorithm effectively clustered samples. Forty-five samples were analyzed, and four clusters were identified. Two presented six samples with high concentrations of Fe (Cluster 1 with four samples) and Cr and Pb (Cluster 2 with two samples). The other 39 samples presented low concentrations of the determined elements (Co, Cr, Cu, Fe, Ni, and Pb). Cadmium, Zn, and Mn were not detected in any of the analyzed samples. Furthermore, integrating energy-dispersive x-ray fluorescence (ED-XRF) and laser-induced breakdown spectroscopy (LIBS) enabled fast direct analysis of nail polish samples, streamlining a swift and reliable data acquisition process. This research underscores the importance of ongoing vigilance and monitoring of potential health hazards associated with nail polish formulations, especially in regions with regulatory restrictions on certain elements.
publishDate 2024
dc.date.none.fl_str_mv 2024-09-01
2025-04-29T18:36:23Z
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv http://dx.doi.org/10.1002/cem.3575
Journal of Chemometrics, v. 38, n. 9, 2024.
1099-128X
0886-9383
https://hdl.handle.net/11449/298179
10.1002/cem.3575
2-s2.0-85196618304
url http://dx.doi.org/10.1002/cem.3575
https://hdl.handle.net/11449/298179
identifier_str_mv Journal of Chemometrics, v. 38, n. 9, 2024.
1099-128X
0886-9383
10.1002/cem.3575
2-s2.0-85196618304
dc.language.iso.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv Journal of Chemometrics
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.source.none.fl_str_mv Scopus
reponame:Repositório Institucional da UNESP
instname:Universidade Estadual Paulista (UNESP)
instacron:UNESP
instname_str Universidade Estadual Paulista (UNESP)
instacron_str UNESP
institution UNESP
reponame_str Repositório Institucional da UNESP
collection Repositório Institucional da UNESP
repository.name.fl_str_mv Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP)
repository.mail.fl_str_mv repositoriounesp@unesp.br
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