Synthesis, characterization and theoretical studies of novel pyrimidine derivatives as potential corrosion inhibitors

Autor:	Akbas Esvet, Yildiz Ela, Erdogan Ahmet
Jazyk:	angličtina
Rok vydání:	2020
Předmět:	corrosion inhibition dft pyrimidine characterization Chemistry QD1-999
Zdroj:	Journal of the Serbian Chemical Society, Vol 85, Iss 4, Pp 481-492 (2020)
Druh dokumentu:	article
ISSN:	0352-5139 1820-7421
DOI:	10.2298/JSC190326081A
Popis:	In this study, five new pyrimidine derivatives were synthesized and characterized by characterization methods such as 1H-NMR, 13C-NMR, FT- -IR and elemental analysis. The corrosion inhibition activity of the synthesized compounds was examined by theoretical calculation using DFT method at the level of B3LYP/6-31G (d,p). According to the calculations, 4-(6-benzoyl-2- -benzylidene-3-oxo-7-phenyl-2,3-dihydro-5H-thiazolo[3,2-a]pyrimidin-5-yl)- benzoic acid (6) appears to be a good inhibitor for corrosion.
Databáze:	Directory of Open Access Journals
Externí odkaz:	https://doaj.org/article/fecd1a4f4c8c488091be5e634807841e Zobrazit plný text záznamu View record in DOAJ Plný text ve formátu PDF