Modeling the Kinetics of Polyethylene Terephthalate and Polyesters with Terminal Hydroxyl Groups Transesterification Reactions

Modeling the Kinetics of Polyethylene Terephthalate and Polyesters with Terminal Hydroxyl Groups Transesterification Reactions Full article

Journal

Polymers
ISSN: 2073-4360

Output data

Year: 2025, Volume: 17, Number: 7, Article number : 992, Pages count : DOI: 10.3390/polym17070992

Authors

Kirshanov Kirill A. ¹ , Toms Roman V. ¹ , Aliev Gadir Sh. ¹ , Ismaylov Daniil A. ¹ , Shagina Natalya Yu. ² , Sokolovskiy Pavel V. ³ , Nizameeva Guliya R. ^4,5 , Gervald Alexander Yu. ¹

Affiliations

1	M.V. Lomonosov Institute of Fine Chemical Technologies, MIREA—Russian Technological University, 119571 Moscow, Russia
2	Department of Oncology, I.M. Sechenov First Moscow State Medical University, 119435 Moscow, Russia
3	N.D. Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, 119991 Moscow, Russia
4	Arbuzov Institute of Organic and Physical Chemistry, FRC Kazan Scientific Center, Russian Academy of Sciences, 420088 Kazan, Russia
5	Department of Physics, Kazan National Research Technological University, 68, K. Marx Str., 420015 Kazan, Russia

Interchain exchange, proceeded by the transesterification mechanism, allows one to obtain polyethylene terephthalate-based polyester products, bypassing the stage of molecular weight reduction and polycondensation used in classical methods of chemical recycling. A kinetic model is presented, which describes the change in the concentrations of bound and terminal units of ethylene glycol from PET and glycol from another polyester, as well as free molecules of ethylene glycol and another glycol, during transesterification reactions for the first time. Experimental data on the dependence of the degree of randomness and conversion on timeduring the interaction of polyethylene terephthalate and oligodiethylene terephthalate with terminal hydroxyl groups with a number-average molecular weight of 860 g/mol in different ratios were obtained. Molecular weight characteristics of the products of PET and oligoesters with hydroxyl end group interchain exchange, with number-average molecular weights from 610 to 860 g/mol, were also investigated. The simulation results were also compared with published data on the dependence of the degree of randomness and conversion on time during ether exchange in PET/PEN blends. The developed kinetic model was found to be in agreement with the experimental data.

Kirshanov K.A. , Toms R.V. , Aliev G.S. , Ismaylov D.A. , Shagina N.Y. , Sokolovskiy P.V. , Nizameeva G.R. , Gervald A.Y.
Modeling the Kinetics of Polyethylene Terephthalate and Polyesters with Terminal Hydroxyl Groups Transesterification Reactions
Polymers. 2025. V.17. N7. 992 . DOI: 10.3390/polym17070992 WOS Scopus OpenAlex

Web of science:	WOS:001463640200001
Scopus:	2-s2.0-105002391832
OpenAlex:	W4409326390

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