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NTOxDNAZ的制备、非等温分解动力学、热容及绝热至爆时间

Preparation, non-isothermal decomposition kinetics, heat capacity and adiabatic time-to-explosion of NTOxDNAZ.

作者信息

Ma Haixia, Yan Biao, Li Zhaona, Guan Yulei, Song Jirong, Xu Kangzhen, Hu Rongzu

机构信息

College of Chemical Engineering, Shaanxi Key Laboratory of Physico-Inorganic Chemistry, Northwest University, Xi'an, Shaanxi 710069, PR China.

出版信息

J Hazard Mater. 2009 Sep 30;169(1-3):1068-73. doi: 10.1016/j.jhazmat.2009.04.057. Epub 2009 Apr 21.

Abstract

NTOxDNAZ was prepared by mixing 3,3-dinitroazetidine (DNAZ) and 3-nitro-1,2,4-triazol-5-one (NTO) in ethanol solution. The thermal behavior of the title compound was studied under a non-isothermal condition by DSC and TG/DTG methods. The kinetic parameters were obtained from analysis of the DSC and TG/DTG curves by Kissinger method, Ozawa method, the differential method and the integral method. The main exothermic decomposition reaction mechanism of NTOxDNAZ is classified as chemical reaction, and the kinetic parameters of the reaction are E(a)=149.68 kJ mol(-1) and A=10(15.81)s(-1). The specific heat capacity of the title compound was determined with continuous C(p) mode of microcalorimeter. The standard mole specific heat capacity of NTOxDNAZ was 352.56 J mol(-1)K(-1) in 298.15K. Using the relationship between C(p) and T and the thermal decomposition parameters, the time of the thermal decomposition from initialization to thermal explosion (adiabatic time-to-explosion) was obtained.

摘要

通过在乙醇溶液中混合3,3 - 二硝基氮杂环丁烷(DNAZ)和3 - 硝基 - 1,2,4 - 三唑 - 5 - 酮(NTO)制备了NTOxDNAZ。采用DSC和TG/DTG方法在非等温条件下研究了标题化合物的热行为。通过基辛格法、小泽法、微分法和积分法对DSC和TG/DTG曲线进行分析,得到了动力学参数。NTOxDNAZ的主要放热分解反应机理归类为化学反应,反应的动力学参数为E(a)=149.68 kJ mol(-1) 和A=10(15.81)s(-1)。采用微量量热仪的连续C(p)模式测定了标题化合物的比热容。在298.15K时,NTOxDNAZ的标准摩尔比热容为352.56 J mol(-1)K(-1)。利用C(p)与T的关系以及热分解参数,得到了从初始到热爆炸(绝热至爆时间)的热分解时间。

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