Xi'an Modern Chemistry Research Institute, Xi'an 710065, China.
Xi'an Modern Chemistry Research Institute, Xi'an 710065, China.
J Hazard Mater. 2017 Apr 5;327:187-196. doi: 10.1016/j.jhazmat.2016.12.049. Epub 2016 Dec 28.
Although N-methyl-P-nitroaniline (MNA) was a quite effective stabilizer in composite modified double base (CMDB) propellants, it undergoes crystallization easily from nitroglycerin (NG) during storage. In order to improve its solubility in nitroglycerin (NG) and the stability in propellants, several new stabilizers including N-ethyl-p-nitroaniline (ENA), N-n-propyl-p-nitroaniline (n-PNA), N-i-propyl-p-nitroaniline (i-PNA), N-n-butyl-p-nitroaniline (n-BNA) and N-t-butyl-p-nitroaniline (t-BNA) were designed and synthesized to replace MNA by increasing the carbon chain length. The interaction between NG and different stabilizers was simulation by Materials Studio 5.5 and the stability and the high temperature stability performance of those new stabilizers in propellants were calculated by Gaussian 09. It was found that both the solubility of new stabilizers in NG and the stability and the high temperature stability performance of those in propellants were improved when the carbon chain length of substitution groups on nitrogen atom was increased. Thus, the n-BNA was a most potential stabilizer. Then all properties of the stabilizers were studied experimentally, which was agreement well with the theoretical analysis.
虽然 N-甲基-P-硝基苯胺(MNA)是一种在复合改性双基(CMDB)推进剂中非常有效的稳定剂,但它在储存过程中很容易从硝化甘油(NG)中结晶。为了提高其在硝化甘油(NG)中的溶解度和推进剂中的稳定性,设计并合成了几种新型稳定剂,包括 N-乙基-P-硝基苯胺(ENA)、N-正丙基-P-硝基苯胺(n-PNA)、N-异丙基-P-硝基苯胺(i-PNA)、N-正丁基-P-硝基苯胺(n-BNA)和 N-叔丁基-P-硝基苯胺(t-BNA),通过增加碳链长度来取代 MNA。通过 Materials Studio 5.5 模拟了 NG 与不同稳定剂之间的相互作用,并通过 Gaussian 09 计算了这些新型稳定剂在推进剂中的稳定性和高温稳定性性能。结果表明,当氮原子上取代基的碳链长度增加时,新型稳定剂在 NG 中的溶解度以及在推进剂中的稳定性和高温稳定性性能都得到了提高。因此,n-BNA 是一种最有潜力的稳定剂。然后对稳定剂的所有性能进行了实验研究,与理论分析吻合较好。