Reactions of ketones with aromatics in acid media. the effect of trifluoromethyl groups and the acidity media. A theoretical study

Journal of Molecular Modeling

Volumn 19, Issue 2, 2013, Pages 793-801

  Castillo, Ulises Jiménez ^a   Zolotukhin, Mikhail G ^a   Fomina, Lioudmila ^a   Nieto, Daniel Romero ^b   Garza, Lilian Olivera ^a   Fomine, Serguei ^a  

^a UNIVERSIDAD NACIONAL AUTÓNOMA DE MÉXICO   (Mexico)

^b UNIVERSITY OF TRIESTE   (Italy)

Author keywords

DFT; Hydroxyalkylation; Protonation; Superacid; Trifluoromethyl group

Indexed keywords

2,2,2 TRIFLUOROACETONE; ACETONE; ACID; BENZENE; CARBONYL DERIVATIVE; HEXAFLUOROACETONE; KETONE; MESYLIC ACID; METHANOL; TRIFLUOROMETHANESULFONIC ACID; UNCLASSIFIED DRUG;

ARTICLE; CHEMICAL REACTION; PRIORITY JOURNAL; PROTON TRANSPORT; THEORETICAL STUDY;

EID: 84877125476     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-012-1610-1     Document Type: Article

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