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Low sensitivity secondary explosives based on 5,7-dinitrobenzotriazole and 4,6-diamino-5,7-dinitrobenzotriazole

机译:基于5,7-二硝基苯并三唑和4,6-二氨基-5,7-二硝基苯唑的低灵敏度二次炸药

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摘要

Nitrogen-rich salts of 5,7-dinitrobenzotriazole such as guanidinium (3), 1-amino-guanidinium (4), 1,3,5-triaminoguanidiniwn (5), ammonium (6) and hydroxylammonium (7) salt were prepared by deprotonation or metathesis reaction from the potassium salt (2). Additionally, 5,7-dinitrobenzotriazole was aminated with trimethylhydrazinium iodide in an aprotic medium to afford 4,6-diamino-5,7-dinitrobenzotriazole (8), which could be further deprotonated to the potassium salt (9). 5,7-Dinitrobenzotriazole (1) and its potassium and guanidinium salts were characterized by single crystal X-ray diffraction. All presented energetic compounds were characterized by multinuclear magnetic resonance study (~1H, ~(13)C and ~(14)N), vibrational analysis (IR and Raman), mass spectra and elemental analysis. Thermal stabilities were studied using differential scanning calorimetry. Detonation parameters were calculated by using the EXPLO5 computer code based on CBS-4M computed enthalpies of formation by Gaussian 09. The presented compounds show detonation performances comparable to TNT. Low sensitivities and high thermal stabilities make the presented compounds interesting for further investigations and possible applications as insensitive HEDM.
机译:制备5,7-二硝基苯并三唑,如胍(3),1-氨基 - 胍(4),1,3,5-三氨基胍基(5),铵(6)和羟铵(7)盐,含氮盐来自钾盐(2)的去质子化或复分解反应。另外,将5,7-二硝基苯并三唑与三甲基酰肼碘化物在非质核培养基中胺化,得到4,6-二氨基-5,7-二硝基苯并三唑(8),其可以进一步脱向至钾盐(9)。通过单晶X射线衍射表征5,7-二硝基苯并三唑(1)及其钾和胍盐。所有呈现的精力量化合物的特征在于多核磁共振研究(〜1H,〜(13)C和〜(14)n),振动分析(IR和拉曼),质谱和元素分析。使用差示扫描量热法研究热稳定性。通过使用基于CBS-4M计算的Gaussian 09的CBS-4M计算的焓来计算爆炸参数。所提出的化合物显示出与TNT相当的爆轰性能。低灵敏度和高热稳定性使所提出的化合物有趣的进一步调查和可能的应用是不敏感的HEDM。

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