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What is the Ullmann Aryl-Aryl Coupling?

The classical Ullmann aryl-aryl coupling homocouples two molecules of an aryl halide into a symmetric biaryl using copper, historically in stoichiometric amounts at high temperature (often well above 200 °C). It was, for decades, essentially the only general method for making biaryl bonds, long before palladium catalysis existed.

Modern ligand-accelerated versions run with catalytic copper at far milder temperatures, and mechanistic studies suggest the reaction can proceed either through discrete Cu(I)/Cu(III) oxidative addition-reductive elimination steps (analogous to the palladium cycle) or through single-electron-transfer, radical-type pathways, depending on the substrate and ligand system — the field has not fully settled on one unified mechanism.

Reaction schemes

Ullmann Aryl-Aryl Coupling — general reaction scheme
Ullmann Aryl-Aryl Coupling — general reaction scheme
Ullmann Aryl-Aryl Coupling — catalytic cycle mechanism
Ullmann Aryl-Aryl Coupling — catalytic cycle mechanism

Catalytic cycle

Step 1

Ar–Cu formation

Copper inserts into the Ar–X bond of one aryl halide molecule, by oxidative addition or a radical pathway.

Step 2

Second C–X activation

A second equivalent of the aryl halide reacts at copper, either via oxidative addition to Cu(III) or radical recombination.

Step 3

C–C bond formation

Reductive elimination (or radical coupling) delivers the symmetric biaryl and regenerates active copper.

Applications

Worked examples

Every example below — reagents, conditions, and literature source — is reproduced from Cross-Coupling Reactions: Mechanisms and Examples by Marcos San Segundo, PhD.

Example 1
Scheme for Example 1 — Ullmann Aryl-Aryl Coupling
Example 2

Synthesis of a diastereoenriched biaryl compound.

Scheme for Synthesis of a diastereoenriched biaryl compound. — Ullmann Aryl-Aryl Coupling
Ref. [1]
Example 3

An intramolecular Ullmann aryl−aryl coupling.

Scheme for An intramolecular Ullmann aryl−aryl coupling. — Ullmann Aryl-Aryl Coupling
Example 4

A coupling using silicon derivatives.

Scheme for A coupling using silicon derivatives. — Ullmann Aryl-Aryl Coupling
Ref. [2]
Cross-Coupling Reactions: Mechanisms and Examples book cover
Textbook · Organic Chemistry

Cross-Coupling Reactions: Mechanisms and Examples

This page covers the Ullmann Aryl-Aryl Coupling — one of 21 named reactions in the book, each with its full catalytic cycle and every worked example shown here, drawn straight from the primary literature.

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References

[1]
Nelson, T. D.; Meyers, A. I. Tetrahedron Lett. 1994, 35, 3259.
[2]
Nishihara, Y.; Ikegashira, K.; Toriyama, F.; Mori, A.; Hiyama,T. Bull. Chem. Soc. Jpn. 2000, 73, 985.

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