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Pentakis(trifluoromethyl)phenyl, a sterically crowded and electron-withdrawing group: synthesis and acidity of pentakis(trifluoromethyl)benzene, -toluene, -phenol, and -aniline.
Kütt A, Movchun V, Rodima T, Dansauer T, Rusanov EB, Leito I, Kaljurand I, Koppel J, Pihl V, Koppel I, Ovsjannikov G, Toom L, Mishima M, Medebielle M, Lork E, Röschenthaler GV, Koppel IA, Kolomeitsev AA. Kütt A, et al. Among authors: kaljurand i. J Org Chem. 2008 Apr 4;73(7):2607-20. doi: 10.1021/jo702513w. Epub 2008 Mar 7. J Org Chem. 2008. PMID: 18324831
Prediction of acidity in acetonitrile solution with COSMO-RS.
Eckert F, Leito I, Kaljurand I, Kütt A, Klamt A, Diedenhofen M. Eckert F, et al. Among authors: kaljurand i. J Comput Chem. 2009 Apr 15;30(5):799-810. doi: 10.1002/jcc.21103. J Comput Chem. 2009. PMID: 18727157
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