Synthesis and tautomerism study of 6-benzoylmethyl-1,3,5-triazin-2,4-diamine
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Authors
Sachdeva, N.
Dolzhenko, Anton
Chui, W.
Date
2011Type
Journal Article
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Sachdeva, Nikhil and Dolzhenko, Anton V. and Chui, Wai Keung. 2011. Synthesis and tautomerism study of 6-benzoylmethyl-1,3,5-triazin-2,4-diamine. Comptes Rendus Chimie. 14(6): 580-587.
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Comptes Rendus Chimie
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School
School of Pharmacy
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The link to the journal’s home page is: http://www.elsevier.com/wps/find/journaldescription.cws_home/600961/description#description. Copyright © 2010 Elsevier B.V. All rights reserved
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Abstract
From the reaction of biguanide with ethyl benzoylacetate, N-(6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)guanidine and 6-benzoylmethyl-1,3,5-triazin-2,4-diamine were isolated.The structural evaluation of 6-benzoylmethyl-1,3,5-triazin-2,4-diamine was performed theoretically (DFT calculations) and experimentally (NMR spectroscopy and X-ray crystallography). The effects of solvents and temperature on keto-enol-enaminone tautomeric equilibrium were explored.
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