Computational Studies of Rubber Ozonation Explain the Effectiveness of 6PPD as an Antidegradant and the Mechanism of Its Quinone Formation

Author:

Rossomme Elliot1234ORCID,Hart-Cooper William M.1,Orts William J.1ORCID,McMahan Colleen M.1,Head-Gordon Martin345ORCID

Affiliation:

1. Bioproducts Research Unit, Agricultural Research Service, U.S. Department of Agriculture, Albany, California 94710, United States

2. Berkeley Center for Green Chemistry, University of California, Berkeley, California 94720, United States

3. Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States

4. Department of Chemistry, University of California, Berkeley, California 94720, United States

5. Kenneth S. Pitzer Center for Theoretical Chemistry, University of California, Berkeley, California 94720, United States

Funder

Basic Energy Sciences

Agricultural Research Service

Publisher

American Chemical Society (ACS)

Subject

Environmental Chemistry,General Chemistry

Reference135 articles.

1. Rapra, S. Global tire manufacturing output to grow 3.4% year-on-year to 2024. 2019.https://www.smithers.com/resources/2019/jun/global-tire-manufacturing-output-to-grow-by-2024 (accessed 2021-01-04).

2. Huntink, N. M. Durability of rubber products: Development of new antidegradants for long-term protection; Twente University Press: Enschede, 2003; pp 1–207.

3. Chemical Antiozonants and Factors Affecting Their Utility

4. Reaction of Ozone with p-Phenylene-Diamine and Related Compounds

5. Bălan, S.; Brushia, R.; Buck, T.; Doherty, A.C.; Ernst, M.; Garland, M.; Grant, K.; Harris, K. Product – Chemical Profile for Motor Vehicle Tires Containing N-(1,3-Dimethylbutyl)-N’-phenyl-p-phenylenediamine (6PPD); 2021.

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