Unveiling the regioselectivity in electrophilic aromatic substitution reactions of deactivated benzenes through molecular electron density theory-Reference-Cited by-同舟云学术

Unveiling the regioselectivity in electrophilic aromatic substitution reactions of deactivated benzenes through molecular electron density theory

Published:2021 Issue:30 Volume:45 Page:13626-13638
ISSN:1144-0546
Container-title:New Journal of Chemistry
language:en
Short-container-title:New J. Chem.

Author:

Domingo Luis R.¹²³⁴^ORCID,Ríos-Gutiérrez Mar¹²³⁴^ORCID,Aurell María José¹²³⁴^ORCID

Affiliation:

1. Department of Organic Chemistry

2. University of Valencia, Dr Moliner 50

3. Valencia

4. Spain

Abstract

Regioselectivity results from the slight polarization of the electron density and weak repulsive interactions appearing along the ortho approach mode.

Funder

Ministerio de Ciencia, Innovación y Universidades

H2020 Euratom

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2021/NJ/D1NJ02435C

Reference55 articles.

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2. M. B. Smith and J.March , March's Advanced Organic Chemistry: Reactions, Mechanisms, and Structure , John Wiley & Sons, Inc. , NY , 2013

3. F. A. Carey and R. J.Sundberg , Advanced Organic Chemistry, Part A: Structure and Mechanisms , Springer , New York , 2008

4. Kinetics of Aromatic Nitration : the Nitronium Ion

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