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Modeling of the nitration of 2-methylpyrimidine-4,6-dione (MPD)

机译:2-甲基吡啶胺-4,6-二酮(MPD)硝化硝化的建模

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The conditions and kinetics of nitration of 2-methylpyrimidine- 4,6-dione (MPD), which leads to the formation of l,l-diamino-2,2-dinitroethene (DADNE, FOX-7), are presented. An analysis of literature data enabled us to propose a simple model of the nitration of MPD. The model was verified on the basis of literature data and our own experimental data. The influence of the rate of nitric acid addition into a model reactor on temperature and composition of the reaction mixture was investigated numerically. The proposed nitration model could be useful in a study of the MPD nitration process on a large scale.
机译:提出了2-甲基嘧啶-4,6-二酮(MPD)的硝化的条件和动力学,这导致形成L,L-二氨基-2,2-二硝基丙烯烯(DADNE,FOX-7)。对文献数据的分析使我们能够提出一个简单的MPD硝化模型。该模型在文献数据和自己的实验数据的基础上进行了验证。在数值上研究了在反应混合物温度和组成上进行硝酸添加到模型反应器中的影响。所提出的硝化模型可用于大规模的MPD硝化过程的研究。

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