Evolving the Scope of 5,5’‐Azobistetrazoles in the Search for High Performing Green Energetic Materials

Abstract

The azotetrazole moiety represents a great platform for energetic materials, it offers a planar and nitrogen‐rich backbone, combined with a high heat of formation, which easily can be functionalized and tuned. Herein, we start from sodium 5‐aminotetrazolate and obtain two isomers by substitution reaction with 2‐chloroethanol. Azidoethyl and nitratoethyl substituted azo‐ tetrazoles were finally synthesized by oxidative azo coupling of the respective N‐ethyl functionalized 5‐aminotetrazole precursors using tert‐butyl hypochlorite as reagent. All compounds were analyzed through multicore NMR and IR spectroscopy as well as mass spectrometry. All solid compounds were further investigated using low‐temperature X‐ray crystallography. The purity was verified by CHNO elemental analysis and the decomposition temperature (DTA) and sensitivities toward impact, friction and electrostatic discharged were determined. Based on the CBS‐4M calculation results, the energetic properties were calculated using the EXPLO5 code.

Document Details

Document Type
Pub Defense Publication
Publication Date
Aug 13, 2021
Source ID
10.1002/ejoc.202100747

Entities

People

  • Jörg Stierstorfer
  • Marcus Lommel
  • Maximilian Benz
  • Michael S Gruhne
  • Nina Krüger
  • Thomas M. Klapötke
  • Tobias Lenz

Organizations

  • Ludwig-Maximilians-Universität München
  • Office of Naval Research
  • Strategic Environmental Research and Development Program

Tags

Fields of Study

  • Chemistry

Readers

  • Organic Chemistry
  • Polymer Science and Technology
  • Rocket Propulsion.