基于C-C桥接dinitropyrazole能量材料的耐热能量材料的合成,表征和性能
Rongzheng Zhang1, Yuangang Xu1, Feng Yang1
1School of Chemistry and Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094, China.
The Journal of organic chemistry
|April 23, 2024
概括
研究人员合成了一种新型的多循环能量材料,1,3-bis(3,5-dinitro-1H-pyrazol-4-yl) -4,6-dinitrobenzene (BDPD),及其盐. 这些化合物具有很高的热稳定性和不敏感性,有望的爆炸性能超过HNS.
科学领域:
- 能量材料科学 能量材料科学
- 有机化学 有机化学
- 材料科学 材料科学 材料科学
背景情况:
- 多环能量材料是具有多个环的结合结构.
- 开发具有增强热稳定性和安全性的新能源材料至关重要.
研究的目的:
- 合成和描述一个新的多环能量分子,1,3-bis(3,5-dinitro-1H-pyrazol-4-yl)-4,6-dinitrobenzene (BDPD),及其离子盐.
- 评估这些新型化合物的热稳定性,灵敏性和爆炸性质.
主要方法:
- 合成BDPD及其离子盐.
- 使用NMR,红外光谱学,质谱学和元素分析进行表征.
- 通过单晶X射线衍射和计算方法进行结构分析 (Multiwfn,Gaussian 09W).
- 使用差分扫描热度计 (DSC) 进行热稳定性评估.
- 敏感性测试 (冲击和摩擦).
- 使用EXPLO5软件进行爆炸性能计算.
主要成果:
- BDPD及其盐已成功合成和表征.
- 证实了高热稳定性,分解温度在319-329.0°C之间.
- 化合物表现出对冲击和摩擦的不敏感性.
- 计算的爆炸性能超过了2.2',4,4',6,6'-hexanitrostilbene (HNS) 的性能.
结论:
- 合成的BDPD衍生品代表了一类有前途的耐热能量材料.
- 它们的高热稳定性,不敏感性和优异的爆炸性能组合需要进一步研究.
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