Guaiacol Nitration in a Simulated Atmospheric Aerosol with an Emphasis on Atmospheric Nitrophenol Formation Mechanisms.


Journal

ACS earth & space chemistry
ISSN: 2472-3452
Titre abrégé: ACS Earth Space Chem
Pays: United States
ID NLM: 101695267

Informations de publication

Date de publication:
20 May 2021
Historique:
received: 18 01 2021
revised: 23 03 2021
accepted: 26 03 2021
entrez: 4 6 2021
pubmed: 5 6 2021
medline: 5 6 2021
Statut: ppublish

Résumé

Atmospheric nitrophenols are pollutants of concern due to their toxicity and light-absorption characteristics and their low reactivity resulting in relatively long residence times in the environment. We investigate multiphase nitrophenol formation from guaiacol in a simulated atmospheric aerosol and support observations with the corresponding chemical mechanisms. The maximal secondary organic aerosol (SOA) yield (42%) is obtained under illumination at 80% relative humidity. Among the identified nitrophenols, 4-nitrocatechol (3.6% yield) is the prevailing species in the particulate phase. The results point to the role of water in catechol and further 4-nitrocatechol formation from guaiacol. In addition, a new pathway of dark nitrophenol formation is suggested, which prevailed in dry air and roughly yielded 1% nitroguaiacols. Furthermore, the proposed mechanism possibly leads to oligomer formation via a phenoxy radical formation by oxidation with HONO.

Identifiants

pubmed: 34084985
doi: 10.1021/acsearthspacechem.1c00014
pmc: PMC8161671
doi:

Types de publication

Journal Article

Langues

eng

Pagination

1083-1093

Informations de copyright

© 2021 The Authors. Published by American Chemical Society.

Déclaration de conflit d'intérêts

The authors declare no competing financial interest.

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Auteurs

Ana Kroflič (A)

Department of Analytical Chemistry, National Institute of Chemistry, Hajdrihova 19, 1000 Ljubljana, Slovenia.
Atmospheric Chemistry Department (ACD), Leibniz-Institute for Tropospheric Research (TROPOS), Permoserstraße 15, 04318 Leipzig, Germany.

Janine Anders (J)

Atmospheric Chemistry Department (ACD), Leibniz-Institute for Tropospheric Research (TROPOS), Permoserstraße 15, 04318 Leipzig, Germany.

Ivana Drventić (I)

Department of Analytical Chemistry, National Institute of Chemistry, Hajdrihova 19, 1000 Ljubljana, Slovenia.

Peter Mettke (P)

Atmospheric Chemistry Department (ACD), Leibniz-Institute for Tropospheric Research (TROPOS), Permoserstraße 15, 04318 Leipzig, Germany.

Olaf Böge (O)

Atmospheric Chemistry Department (ACD), Leibniz-Institute for Tropospheric Research (TROPOS), Permoserstraße 15, 04318 Leipzig, Germany.

Anke Mutzel (A)

Atmospheric Chemistry Department (ACD), Leibniz-Institute for Tropospheric Research (TROPOS), Permoserstraße 15, 04318 Leipzig, Germany.

Jörg Kleffmann (J)

Physical and Theoretical Chemistry, University of Wuppertal, Gaußstraße 20, 42119 Wuppertal, Germany.

Hartmut Herrmann (H)

Atmospheric Chemistry Department (ACD), Leibniz-Institute for Tropospheric Research (TROPOS), Permoserstraße 15, 04318 Leipzig, Germany.

Classifications MeSH