Central Composite Experimental Design Applied to the Catalytic Carbon-Sulfur Bond Formation by Fluorapatite Catalyst

摘要

The aim of this study was to apply experimental design in the optimization of the thia-Michael addition reaction between chalcone derivatives and mercaptans catalyzed by Fluorapatite catalyst (FAP). The central composite design was used to design an experimental program to provide data to model the effects of various factors on reaction yield (Y). The variables chosen were catalyst weight (X1), reaction time (X2) and solvent volume (X3). The mathematical relationship of reaction yield on the three significant independent variables can be approximated by a nonlinear polynomial model. Predicted values were found to be in good agreement with experimental values. The optimum reaction conditions (x1= 350 mg, x2= 30 min and x3= 2 mL) for reaction model (chalcone and thiophenol) obtained by response surface were applied to other substrates. This study has shown that central composite design could efficiently be applied for the modeling of catalytic carbon-sulfur bond formation by FAP catalyst under mild reaction condition with high yield, and it is an economical way of obtaining the maximum amount of information with the fewest number of experiments.