The discovery of novel chemical reactions or reaction sequences that are able to generate useful chemical products may be regarded as the heart of organic chemistry. We present here concepts and methods on how to find and explore new multi component reactions, especially with automated combinatorial methods. This "combinatorial reaction finding" provides also a powerful tool to the understandin...

The catalytic ability of ZrO(2)/SO(4)(2-) to promote solventless three-component condensation reactions of a diversity of aromatic aldehydes, urea or thoiurea and ethyl acetoacetate was studied. Products resulting from Hantzsch and/or Biginelli multi-component reactions are obtained in the presence of solid acid catalysts using the same reactants but different temperature conditions. The sulfat...

Nano-silica-bonded 3-n-propyl-1-sulfonic acid imidazolium chloride (nano-SB-[PSIM]Cl) was applied as a highly efficient, general and heterogeneous catalyst for one pot multi-component reaction of 2-naphthol, arylaldehydes, and thioacetamide leading to 1-thioamidolakyl-2-naphthols. All reactions proceeded with excellent yields in short times under solvent-free conditions. Our protocol w...

Nano-silica-bonded 3-n-propyl-1-sulfonic acid imidazolium chloride (nano-SB-[PSIM]Cl) was applied as a highly efficient, general and heterogeneous catalyst for one pot multi-component reaction of 2-naphthol, arylaldehydes, and thioacetamide leading to 1-thioamidolakyl-2-naphthols. All reactions proceeded with excellent yields in short times under solvent-free conditions. Our protocol was superi...

In this research, a series of spiro compounds was efficiently synthesized via one-pot multi component reactions of isatins, aryl amines, dimethyl acetylenedicarboxylate and hydrazine in the presence of Zn(BDC) MOF as catalyst. The key superiority of this process is high yields, easy work-up, short reaction times, and purification of the products by the non-chromatographic system. The study of t...

this article deals with the issues associated with developing a new design methodology for the nonlinear model-predictive control (mpc) of a chemical plant. a combination of multiple neural networks is selected and used to model a nonlinear multi-input multi-output (mimo) process with time delays.  an optimization procedure for a neural mpc algorithm based on this model is then developed. the p...

A general synthetic route to the synthesis of imidazoles has been developed using nano SbCl5/SiO2 under solvent-free conditions. The multi-component reactions of aldehydes, benzil and ammonium acetate were carried out to afford some trisubstituted imidazole derivatives. This method provides several advantages like simple work-up, environmentally benign, and shorter reaction times along wi...

One of the important Multi-component reaction (MCRs) is the synthesis of dihydropyrano chromene derivatives by one-pot reaction. In this research, an inexpensive and effective one pot three component procedure with good yields for the synthesis of dihydro pyrano chromenes is reported. In this method, the synthesis of pyrano chromene derivatives was followed by using 4-hydroxycoumarin, malononit...

The functional properties of multi-component materials are often determined by a rearrangement of their different phases and by chemical reactions of their components. In this contribution, a material model is presented which enables computational simulations and structural optimization of solid multi-component systems. Typical Systems of this kind are anodes in batteries, reactive polymer blen...