Theoretical study of the mechanism and regioselectivity of the alkylation reaction of the phenoxide ion in polar protic and aprotic solvents

Author:

Nogueira Isac C.,Pliego Josefredo R.

Funder

CNPq

FAPEMIG

CAPES

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry

Reference54 articles.

1. Advanced Organic Chemistry: Part A: Structure and Mechanisms;Carey,2000

2. Advanced Organic Chemistry. Part B: Reactions and Synthesis;Carey,2001

3. March's Advanced Organic Chemistry: Reactions, Mechanisms, and Structure;Smith,2007

4. Elementary SN2 reaction revisited. Effects of solvent and alkyl chain length on kinetics of halogen exchange in haloalkanes elucidated by Empirical Valence Bond simulation;Jug;Comput. Theor. Chem.,2017

5. Revealing a double-inversion mechanism for the F−+CH3Cl SN2 reaction;Szabó;Nat. Commun.,2015

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