Kinetic Modeling of Ring Opening Polymerization of Lactones Under Microwave Irradiation

2021 ◽  
pp. 2100044
Author(s):  
Porfirio López‐Domínguez ◽  
Nathalie Michelle Carranco‐Hernández ◽  
Eduardo Vivaldo‐Lima
2020 ◽  
Author(s):  
Antoine Tardy ◽  
Noémie Gil ◽  
Christopher M. Plummer ◽  
Didier Siri ◽  
Didier Gigmes ◽  
...  

Radical Ring-Opening polymerization (rROP) of Cyclic Ketene Acetals (CKAs) combines the advantages of both ring-opening and radical polymerization thereby allowing the robust production of polyesters. In this article we investigate in detail the radical ring-opening polymerization of model CKA monomers and demonstrate by the combination of DFT calculations and kinetic modeling using PREDICI software that we are now able to predict <i>in silico</i> the ring-opening ability of CKA monomers<br>


2020 ◽  
Author(s):  
Antoine Tardy ◽  
Noémie Gil ◽  
Christopher M. Plummer ◽  
Didier Siri ◽  
Didier Gigmes ◽  
...  

Radical Ring-Opening polymerization (rROP) of Cyclic Ketene Acetals (CKAs) combines the advantages of both ring-opening and radical polymerization thereby allowing the robust production of polyesters. In this article we investigate in detail the radical ring-opening polymerization of model CKA monomers and demonstrate by the combination of DFT calculations and kinetic modeling using PREDICI software that we are now able to predict <i>in silico</i> the ring-opening ability of CKA monomers<br>


e-Polymers ◽  
2010 ◽  
Vol 10 (1) ◽  
Author(s):  
Marco Frediani ◽  
David Sémeril ◽  
Dominique Matt ◽  
Fabio Rizzolo ◽  
Anna Maria Papini ◽  
...  

AbstractSince the first contributions by Gedye and Giguere in 1986, growing attention has been registered on the use of microwave heating in organic synthesis. However still many aspects need to be clarified especially about the so called “microwave effect” and the possible degradation phenomena that may be recognized during polymer synthesis. In this work the complex cone-25,27- dipropyloxy-26,28-dioxo-calix[4]arene titanium (IV) dichloride (1) has been tested for the ring opening polymerization of L-lactide, comparing the effect of conventional heating with a possible microwave assisted strategy. The polymers obtained were fully characterized (NMR, IR, HPLC-SEC, DSC, MALDI-TOF and WAXD analysis). As expected the use of microwave irradiation induced an increase of the polymerization rate. On the other side the use of microwaves resulted in a slight loss of the control over molecular weight and molecular weight distribution if compared with a conventional thermal treatment.


2002 ◽  
Vol 40 (14) ◽  
pp. 2264-2275 ◽  
Author(s):  
Xiaomei Fang ◽  
Christopher D. Simone ◽  
Eleonora Vaccaro ◽  
Samuel J. Huang ◽  
Daniel A. Scola

2006 ◽  
Vol 57 (6) ◽  
pp. 873-880 ◽  
Author(s):  
Ying Li ◽  
Xiu-Li Wang ◽  
Ke-Ke Yang ◽  
Yu-Zhong Wang

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