PMID- 37722476 OWN - NLM STAT- MEDLINE DCOM- 20231026 LR - 20231112 IS - 1873-6424 (Electronic) IS - 0269-7491 (Linking) VI - 337 DP - 2023 Nov 15 TI - Interaction of fluorene and its analogs with high-density polyethylene microplastics: An assessment of the adsorption mechanism to establish the effects of heteroatoms in the molecule. PG - 122573 LID - S0269-7491(23)01575-0 [pii] LID - 10.1016/j.envpol.2023.122573 [doi] AB - The threat of microplastics (MP) pollution in aquatic ecosystems can be even more severe for they are able to interact with organic pollutants that can migrate to adjacent environments. The presence of heteroatoms in organic pollutants can directly influence adsorption onto MP. This research evaluated the adsorption of fluorene (FLN) and its heteroatom analogs dibenzothiophene (DBT), dibenzofuran (DBF) and carbazole (CBZ) onto high-density polyethylene (HDPE) MP from residual (HDPE(res)) and commercial (HDPE(com)) sources. The Langmuir isotherm showed a better fit, while DBT showed higher maximum adsorption capacity (19.2 and 15.8 mumol g(-1)) followed by FLN (13.4 and 11.7 mumol g(-1)), and DBF (13.5 and 10.3 mumol g(-1)) to the HDPE(com) and HDPE(res,) respectively, which indicates a direct correlation with the hydrophobicity of the molecules determined by Log K(ow). In contrast, CBZ showed no significant interaction with MP, due to their polar characteristic, thus, no kinetic and thermodynamic parameters could be determined. The adsorption process of all PAH was determined to be exothermic and spontaneous, with low temperatures favoring the process. The pseudo-second-order kinetic models have fitted to the adsorption onto both HDPE; intraparticle diffusion was also observed. Computational studies, physical characterization techniques and batch adsorption experiments demonstrated that the mechanism is governed by hydrophobic interactions, with van der Waals forces as a secondary effect in the adsorption of FLN, DBT and DBF onto HDPE(res) and HDPE(com). Thus, allowing a deeper understanding of the interactions between HDPE MP and FLN as well with its derivatives. CI - Copyright (c) 2023 Elsevier Ltd. All rights reserved. FAU - Frescura, Lucas Mironuk AU - Frescura LM AD - Universidade Federal de Santa Maria - UFSM, Department of Chemistry, Av. Roraima, 1000, 97105-900, Santa Maria, RS, Brazil. FAU - Funari Junior, Ronaldo Antunes AU - Funari Junior RA AD - Universidade Federal de Santa Maria - UFSM, Department of Chemistry, Av. Roraima, 1000, 97105-900, Santa Maria, RS, Brazil. FAU - Brummelhaus de Menezes, Bryan AU - Brummelhaus de Menezes B AD - Universidade Federal de Santa Maria - UFSM, Department of Chemistry, Av. Roraima, 1000, 97105-900, Santa Maria, RS, Brazil. FAU - Flavia de Moraes Bastos, Ana AU - Flavia de Moraes Bastos A AD - Universidade Federal de Santa Maria - UFSM, Department of Chemistry, Av. Roraima, 1000, 97105-900, Santa Maria, RS, Brazil. FAU - Barcellos da Rosa, Marcelo AU - Barcellos da Rosa M AD - Universidade Federal de Santa Maria - UFSM, Department of Chemistry, Av. Roraima, 1000, 97105-900, Santa Maria, RS, Brazil. Electronic address: marcelo.b.rosa@ufsm.br. LA - eng PT - Journal Article DEP - 20230916 PL - England TA - Environ Pollut JT - Environmental pollution (Barking, Essex : 1987) JID - 8804476 RN - 0 (Microplastics) RN - 9002-88-4 (Polyethylene) RN - 0 (Plastics) RN - 3Q2UY0968A (fluorene) RN - 0 (Fluorenes) RN - 0 (Environmental Pollutants) RN - 0 (Water Pollutants, Chemical) SB - IM MH - Microplastics/chemistry MH - Polyethylene/chemistry MH - Plastics/chemistry MH - Ecosystem MH - Adsorption MH - Fluorenes MH - *Environmental Pollutants MH - Kinetics MH - *Water Pollutants, Chemical/analysis OTO - NOTNLM OT - Adsorption mechanism OT - Fluorene heteroatomic analogs OT - High-density polyethylene microplastics OT - Hydrophobic adsorption COIS- Declaration of competing interest The authors declare that they have no known competing financial interests or personal relationships that could have appeared to influence the work reported in this paper. EDAT- 2023/09/19 00:43 MHDA- 2023/10/26 06:42 CRDT- 2023/09/18 19:12 PHST- 2023/06/12 00:00 [received] PHST- 2023/09/09 00:00 [revised] PHST- 2023/09/15 00:00 [accepted] PHST- 2023/10/26 06:42 [medline] PHST- 2023/09/19 00:43 [pubmed] PHST- 2023/09/18 19:12 [entrez] AID - S0269-7491(23)01575-0 [pii] AID - 10.1016/j.envpol.2023.122573 [doi] PST - ppublish SO - Environ Pollut. 2023 Nov 15;337:122573. doi: 10.1016/j.envpol.2023.122573. Epub 2023 Sep 16.