Controlled synthesis of electron deficient nitro-1H-benzotriazoles

Callum J. McHugh; Daniel R. Tackley; Duncan Graham

doi:10.3987/COM-02-9505

Controlled synthesis of electron deficient nitro-1H-benzotriazoles

Callum J. McHugh
, Daniel R. Tackley
, Duncan Graham

Research output: Contribution to journal › Article › peer-review

9 Citations (Scopus)

Abstract

Nitro-1H-benzotriazole derivatives containing electron withdrawing substitutents in the ortho and meta positions to the nitro group have been synthesized by the simple and direct nitration of the parent 1H-benzotriazoles. The route of nitration and assignment of isomerism in these compounds is proposed based upon high level density functional theory (DFT) calculations.

Original language	English
Pages (from-to)	1461-1470
Number of pages	10
Journal	Heterocycles
Volume	57
Issue number	8
DOIs	https://doi.org/10.3987/COM-02-9505
Publication status	Published - 2002
Externally published	Yes

Keywords

PREPARATION
Nitration
1H-benzotriazole
isomerism
DFT
Chemistry
Organic Chemistry
Analytical Chemistry
Pharmacology

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10.3987/COM-02-9505

Cite this

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title = "Controlled synthesis of electron deficient nitro-1H-benzotriazoles",

abstract = "Nitro-1H-benzotriazole derivatives containing electron withdrawing substitutents in the ortho and meta positions to the nitro group have been synthesized by the simple and direct nitration of the parent 1H-benzotriazoles. The route of nitration and assignment of isomerism in these compounds is proposed based upon high level density functional theory (DFT) calculations.",

keywords = "PREPARATION, Nitration, 1H-benzotriazole, isomerism, DFT, Chemistry, Organic Chemistry, Analytical Chemistry, Pharmacology",

author = "McHugh, \{Callum J.\} and Tackley, \{Daniel R.\} and Duncan Graham",

year = "2002",

doi = "10.3987/COM-02-9505",

language = "English",

volume = "57",

pages = "1461--1470",

journal = "Heterocycles",

publisher = "Japan Institute of Heterocyclic Chemistry",

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TY - JOUR

T1 - Controlled synthesis of electron deficient nitro-1H-benzotriazoles

AU - McHugh, Callum J.

AU - Tackley, Daniel R.

AU - Graham, Duncan

PY - 2002

Y1 - 2002

N2 - Nitro-1H-benzotriazole derivatives containing electron withdrawing substitutents in the ortho and meta positions to the nitro group have been synthesized by the simple and direct nitration of the parent 1H-benzotriazoles. The route of nitration and assignment of isomerism in these compounds is proposed based upon high level density functional theory (DFT) calculations.

AB - Nitro-1H-benzotriazole derivatives containing electron withdrawing substitutents in the ortho and meta positions to the nitro group have been synthesized by the simple and direct nitration of the parent 1H-benzotriazoles. The route of nitration and assignment of isomerism in these compounds is proposed based upon high level density functional theory (DFT) calculations.

KW - PREPARATION

KW - Nitration

KW - 1H-benzotriazole

KW - isomerism

KW - DFT

KW - Chemistry

KW - Organic Chemistry

KW - Analytical Chemistry

KW - Pharmacology

U2 - 10.3987/COM-02-9505

DO - 10.3987/COM-02-9505

M3 - Article

VL - 57

SP - 1461

EP - 1470

JO - Heterocycles

JF - Heterocycles

IS - 8

ER -

Controlled synthesis of electron deficient nitro-1H-benzotriazoles

Abstract

Keywords

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