CHINESE JOURNAL OF ENERGETIC MATERIALS
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A Novel Melt-casting Explosive 5-Methyl nitrate-1,5-dinitrooxazine:Synthesis, Crystal Structure and Properties
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1.Xi′an Modern Chemistry Research Institute, Xi′an 710065, China;2.State Key Laboratory of Fluorine & Nitrogen Chemicals, Xi′an 710065, China

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    Abstract:

    Using nitromethane, tert-butylamine and formaldehyde as raw materials, a novel melt-casting explosive 5-methylnitrate-1,5-dinitrooxazine (TNOP) was synthesized via condensation and nitration reactions with the total yield of 46.2%. FT-IR, 1H NMR, 13C NMR, elemental analysis and single-crystal testing approaches were conducted to obtain the structure of TNOP, disclosing an orthorhombic crystal structure with a space group of Pbca and the density of 1.722 g·cm-3. The melting point and thermal decomposition temperature were examined to 110.8 ℃ and 203.5 ℃ using DSC technique, respectively. Furthermore, the detonation velocity and the detonation pressure are predicted to be 8112 m·s-1 and 29.23 GPa based on calculated enthalpy of solid phase formation (-346.6 kJ·mol-1). In addition, an impact sensitivity of 50 J could be obtained for TNOP. By coordinating the energetic groups N—NO2, C—NO2 and —ONO2 and facile synthesis process, TNOP was revealed with high energy, low melting point and low sensitivity, implying that it can be used as potential melt-casting explosive in weapons.

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杨凯迪,张家荣,薛琪,等.新型熔铸炸药5-甲基硝酸酯-1,5-二硝基噁嗪烷:合成、晶体结构与性能[J].含能材料,2021,29(4):272-277.
YANG Kai-di, ZHANG Jia-rong, XUE Qi, et al. A Novel Melt-casting Explosive 5-Methyl nitrate-1,5-dinitrooxazine:Synthesis, Crystal Structure and Properties[J]. Chinese Journal of Energetic Materials,2021,29(4):272-277.

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History
  • Received:March 09,2021
  • Revised:April 13,2021
  • Adopted:April 07,2021
  • Online: April 08,2021
  • Published: April 25,2021