Structure, thermal stability, antioxidant activity and DFT studies of trisphenols and related phenols

CORC > 宁波材料技术与工程研究所 > 中国科学院宁波材料技术与工程研究所 > 2017专题

	Structure, thermal stability, antioxidant activity and DFT studies of trisphenols and related phenols
	Yu, Shasha; Wang, Yishan; Maa, Yujie; Wang, Limin; Zhu, Jia; Liu, Shenggao
刊名	INORGANICA CHIMICA ACTA
	2017
卷号	468 页码:159-170
ISSN号	0020-1693
英文摘要	Two kinds of trisphenols have been successfully synthesized and their structures were confirmed by IR spectra, (HNMR)-H-1, (CNMR)-C-13, mass spectra and X-ray diffraction. They exhibited better thermal stability than both monophenol and bisphenols due to their higher molecular weight. Moreover, their antioxidant activities have been investigated in lubricant oil using PDSC and RBOT. The results showed that the otrisphenol 3b exhibited the best antioxidant activity while the p-trisphenol 3a was the worst. In addition, their relationship between structures and properties has been further explored by a series of DFT calculations including the BDE values, the IP values and the Gibbs free energy barriers for the reaction between phenols and methylperoxyl radicals. (C) 2017 Elsevier B. V. All rights reserved.
公开日期	2017-12-25
内容类型	期刊论文
源URL	[http://ir.nimte.ac.cn/handle/174433/13548]
专题	2017专题
推荐引用方式 GB/T 7714	Yu, Shasha,Wang, Yishan,Maa, Yujie,et al. Structure, thermal stability, antioxidant activity and DFT studies of trisphenols and related phenols[J]. INORGANICA CHIMICA ACTA,2017,468:159-170.
APA	Yu, Shasha,Wang, Yishan,Maa, Yujie,Wang, Limin,Zhu, Jia,&Liu, Shenggao.(2017).Structure, thermal stability, antioxidant activity and DFT studies of trisphenols and related phenols.INORGANICA CHIMICA ACTA,468,159-170.
MLA	Yu, Shasha,et al."Structure, thermal stability, antioxidant activity and DFT studies of trisphenols and related phenols".INORGANICA CHIMICA ACTA 468(2017):159-170.