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Digitizing Chemical Synthesis in 3D Printed Reactionware.

Andrius Bubliauskas1, Daniel J Blair2, Henry Powell-Davies1

  • 1School of Chemistry, The University of Glasgow, Glasgow, G12 8QQ, UK.

Angewandte Chemie (International Ed. in English)
|March 8, 2022
PubMed
Summary
This summary is machine-generated.

Digitizing organic synthesis requires standardized, modular hardware. This study presents a new approach combining process chemistry and 3D printed reactionware for reproducible chemical coding and synthesis.

Keywords:
3D PrintingChemical EducationC−C CouplingReactionwareUnit Operations

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Area of Science:

  • Organic Chemistry
  • Chemical Engineering
  • Digital Chemistry

Background:

  • Standardizing chemistry digitization is crucial for linking experimental data and code.
  • Current methods lack standardization, hindering chemical code portability.
  • A universal approach using modular hardware and well-defined standards is needed.

Purpose of the Study:

  • To present a novel approach for digitizing organic synthesis.
  • To combine process chemistry principles with 3D printed reactionware.
  • To establish a standard for reproducible chemical coding.

Main Methods:

  • Developing a digitization process for organic synthesis.
  • Utilizing modular hardware and 3D printed reactionware.
  • Translating unit operations into digitized hardware and instructions.

Main Results:

  • Successfully digitized the synthesis of 3 MIDA boronate building blocks.
  • Demonstrated digitization for ester hydrolysis, Wittig olefination, and Suzuki-Miyaura coupling.
  • Outlined the process for synthesizing the drug sulfanilamide using the new method.

Conclusions:

  • The presented approach enables effective and reproducible organic synthesis digitization.
  • This method bridges process chemistry and digital tools for enhanced chemical coding.
  • The strategy facilitates the portability and standardization of chemical synthesis protocols.