Evaluation of Reactivity (pKa) of Substituted Aromatic Diamines, Monomers for Polyamides Synthesis, via Nuclear Magnetic Resonance, NMR-1H

Autor: María Teresa Cabrera Pedroso, Carla Bernal Villavicencio, Joseph Cruel Siguenza, Juan Enrique Tacoronte Morales
Rok vydání: 2020
Předmět:
Zdroj: The 24th International Electronic Conference on Synthetic Organic Chemistry.
DOI: 10.3390/ecsoc-24-08436
Popis: The relationship between properties of aromatic polyamides and the structure and pKa of substituted diamine monomers allows for modeling and designing the synthesis of polymers with special properties for different uses (dialysis membranes, ion exchange systems, to thermo-resistant materials and impact protection devices). Nuclear Magnetic Resonance is a versatile analytical tool for such purposes. Based on the obtained equations (pKa = 13.1512 − 1.67039 × (ppm)), and chemical shift (, ppm) = −7.0593 − (37.57628 × φ) the reactivity of the monomers can be calculated and selectively modify some properties of polyamides. Aromatic diamines were synthetized according to established protocols and statistical-molecular studies were developed using Hyperchem pack-2005 and Mopac-6.
Databáze: OpenAIRE