赫克萨基斯-2-(β-碳氧乙烯氧) 环三:合成,特性,建模结构
Pavel Yudaev1, Anastasia Konstantinova1, Vladimir Volkov2
1Mendeleev University of Chemical Technology of Russia, Miusskaya sq., 9, 125047 Moscow, Russia.
Molecules (Basel, Switzerland)
|September 28, 2023
概括
赫克萨克斯-2-(β-碳氧乙烯氧) 环三酸 (2-CEPP) 的合成和特征. 在加热后,2-CEPP通过脱碳化和聚合形成一种不溶性,耐热的聚合物.
科学领域:
- 材料科学 材料科学 材料科学
- 有机化学 有机化学
- 聚合物化学 聚合物化学
背景情况:
- 循环三酸是一种多功能无机有机混合化合物,具有可调节的特性.
- 循环三酸的功能化可以导致具有特定热和化学行为的新材料.
研究的目的:
- 为了合成和表征一种新型环三衍生物,hexakis-2-(β-carboxyethenylphenoxy) 环三 (2-CEPP).
- 研究2-CEPP作为耐热材料的前体的热行为和潜在应用.
主要方法:
- 通过凝结反应合成2-CEPP.
- 使用NMR光谱 (31P,1H,1C) 和MALDI-TOF质谱法进行结构性表征.
- 量子化学计算 (ab initio,DFT-PBE0/6-311g**) 用于理论估计酸强度.
- 使用小角度X射线散射 (SAXS) 分析物理状态和相位过渡.
- 热分析包括差分扫描热量计 (DSC) 和固态13CNMR光谱,以研究热分解和聚合.
主要成果:
- 通过光谱和质谱技术成功证实了2-CEPP的结构.
- 量子化学计算为2-CEPP的酸强度提供了理论见解.
- 萨克斯分析表明,2-CEPP是无形的,但在加热时可以结晶.
- 在370°C,2-CEPP经过脱碳化和聚合,产生一种不溶性,耐热的产品.
- DSC和固态13C NMR证实了脱碳化和聚合反应.
结论:
- 2-CEPP是一种新型循环三酸衍生物,具有作为高性能聚合物的前体的潜力.
- 2-CEPP的热分解途径涉及脱碳化和聚合,从而产生坚固,不溶性材料.
- 这项研究突出了功能化循环三酸在开发先进耐热聚合物的潜力.
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