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Literature DB >> 26815081

Towards dial-a-molecule by integrating continuous flow, analytics and self-optimisation.

Abstract

The employment of continuous-flow platforms for synthetic chemistry is becoming increasingly popular in research and industrial environments. Integrating analytics in-line enables obtaining a large amount of information in real-time about the reaction progress, catalytic activity and stability, etc. Furthermore, it is possible to influence the reaction progress and selectivity via manual or automated feedback optimisation, thus constituting a dial-a-molecule approach employing digital synthesis. This contribution gives an overview of the most significant contributions in the field to date.

Entities: Chemical

Year: 2016 PMID： 26815081 PMCID： PMC6057606 DOI： 10.1039/c5cs00793c

Source DB: PubMed Journal: Chem Soc Rev ISSN： 0306-0012 Impact factor: 54.564

38 in total

Review 1. Process and reaction monitoring by low-field NMR spectroscopy.

Authors: Franz Dalitz; Markus Cudaj; Michael Maiwald; Gisela Guthausen
Journal: Prog Nucl Magn Reson Spectrosc Date: 2011-12-06 Impact factor: 9.795

2. Real-time feedback control using online attenuated total reflection Fourier transform infrared (ATR FT-IR) spectroscopy for continuous flow optimization and process knowledge.

Authors: Ryan A Skilton; Andrew J Parrott; Michael W George; Martyn Poliakoff; Richard A Bourne
Journal: Appl Spectrosc Date: 2013-10 Impact factor: 2.388

Towards dial-a-molecule by integrating continuous flow, analytics and self-optimisation.

Review 1. Process and reaction monitoring by low-field NMR spectroscopy.

2. Real-time feedback control using online attenuated total reflection Fourier transform infrared (ATR FT-IR) spectroscopy for continuous flow optimization and process knowledge.

3. Why is chemical synthesis and property optimization easier than expected?

4. Improved method for kinetic studies in microreactors using flow manipulation and noninvasive Raman spectrometry.

5. Molecularly-mediated assemblies of plasmonic nanoparticles for Surface-Enhanced Raman Spectroscopy applications.

6. Configurable 3D-Printed millifluidic and microfluidic 'lab on a chip' reactionware devices.

7. Synthesis of many different types of organic small molecules using one automated process.

8. Closed-Loop Multitarget Optimization for Discovery of New Emulsion Polymerization Recipes.

9. A self optimizing synthetic organic reactor system using real-time in-line NMR spectroscopy.

10. 3D-printed devices for continuous-flow organic chemistry.

Review 1. The Molecular Industrial Revolution: Automated Synthesis of Small Molecules.

Review 2. Biomimetic molecular design tools that learn, evolve, and adapt.

3. An autonomous organic reaction search engine for chemical reactivity.

4. 3D printed fluidics with embedded analytic functionality for automated reaction optimisation.

5. Self-optimisation and model-based design of experiments for developing a C-H activation flow process.

6. Continuous Flow ¹H and ¹³C NMR Spectroscopy in Microfluidic Stripline NMR Chips.

Review 7. NMR reaction monitoring in flow synthesis.

8. Controlling an organic synthesis robot with machine learning to search for new reactivity.

Review 9. Digitising chemical synthesis in automated and robotic flow.

10. Mass spectrometric directed system for the continuous-flow synthesis and purification of diphenhydramine.