Publication Details

Category Text Publication
Reference Category Journals
DOI 10.1021/acs.est.5c03567
Licence creative commons licence
Title (Primary) Photochemical chain scissions enhance polyethylene glycol biodegradability: from probabilistic modeling to experimental demonstration
Author Kleemann, K.; Jaggi, M.; Bernasconi, S.M.; Schmitz, R.A.; Künkel, A.; Simon, C. ORCID logo ; McNeill, K.; Battagliarin, G.; Sander, M.
Source Titel Environmental Science & Technology
Year 2025
Department EAC
Volume 59
Issue 33
Page From 17773
Page To 17784
Language englisch
Topic T9 Healthy Planet
Supplements https://pubs.acs.org/doi/suppl/10.1021/acs.est.5c03567/suppl_file/es5c03567_si_001.pdf
Keywords polyethylene glycol (PEG); photochemical degradation; hydroxyl radicals; chain scission; molecular weight distribution; biodegradability; soil; sediment environmental fate
Abstract Polyethylene glycols (PEGs), a major class of water-soluble polymers (WSPs), are widely used in diverse applications, from which PEGs may be released into the environment. This work investigates the effect of PEG reaction with photochemically produced hydroxyl radicals (center dot OH), an important environmental oxidant, on the molecular weight (MW) distribution of PEGs and their subsequent biodegradation in soil and sediment. Monte Carlo simulations demonstrated a pronounced decrease in the PEG MW after only a few center dot OH-reaction-induced chain scissions on initial PEG molecules. The simulation results were validated by experimentally reacting 13C-labeled PEGs ( M n = 6380 +/- 400 Da) with photochemically produced center dot OH to three extents and by analyzing the formed low MW PEG reaction products. Incubation of unreacted and center dot OH-reacted PEGs in both a sediment and a soil over 150 days demonstrated increasing rates and extents of PEG biodegradation into 13CO2 with increasing center dot OH-reaction extent and thus increasing amounts of low MW PEG products. This work underscores the importance of considering WSP MW distributions and dynamics caused by biotic or abiotic chain scission reactions when advancing a detailed understanding of WSP fate and biodegradability in natural and engineered receiving environments.
Persistent UFZ Identifier https://www.ufz.de/index.php?en=20939&ufzPublicationIdentifier=31250
Kleemann, K., Jaggi, M., Bernasconi, S.M., Schmitz, R.A., Künkel, A., Simon, C., McNeill, K., Battagliarin, G., Sander, M. (2025):
Photochemical chain scissions enhance polyethylene glycol biodegradability: from probabilistic modeling to experimental demonstration
Environ. Sci. Technol. 59 (33), 17773 - 17784 10.1021/acs.est.5c03567