Atmospheric Autoxidation of Organophosphate Esters.
atmospheric oxidation
peroxy radicals (RO2•)
quantum chemical calculations
secondary organic aerosol (SOA)
volatile chemical products (VCPs)
Journal
Environmental science & technology
ISSN: 1520-5851
Titre abrégé: Environ Sci Technol
Pays: United States
ID NLM: 0213155
Informations de publication
Date de publication:
07 06 2022
07 06 2022
Historique:
pubmed:
19
11
2021
medline:
9
6
2022
entrez:
18
11
2021
Statut:
ppublish
Résumé
Organophosphate esters (OPEs), widely used as flame retardants and plasticizers, have frequently been identified in the atmosphere. However, their atmospheric fate and toxicity associated with atmospheric transformations are unclear. Here, we performed quantum chemical calculations and computational toxicology to investigate the reaction mechanism of peroxy radicals of OPEs (OPEs-RO
Identifiants
pubmed: 34793133
doi: 10.1021/acs.est.1c04817
doi:
Substances chimiques
Esters
0
Flame Retardants
0
Organophosphates
0
Phosphates
0
Types de publication
Journal Article
Research Support, Non-U.S. Gov't
Langues
eng
Sous-ensembles de citation
IM