CAS 117269-72-4

Bromo[(3-cyanophenyl)methyl]zinc

Description:

Bromo[(3-cyanophenyl)methyl]zinc, with the CAS number 117269-72-4, is an organozinc compound characterized by the presence of a bromo substituent and a cyanophenyl group attached to a zinc center. This compound typically exhibits a coordination number of four, where zinc is tetrahedrally coordinated by the bromo group and the cyanophenylmethyl moiety. It is often utilized in organic synthesis, particularly in cross-coupling reactions, due to its ability to act as a nucleophile. The presence of the cyano group enhances the electrophilicity of the compound, making it a valuable intermediate in the synthesis of various organic compounds. Additionally, bromo[(3-cyanophenyl)methyl]zinc is sensitive to moisture and air, necessitating careful handling under inert atmospheres. Its reactivity profile allows for the formation of carbon-carbon bonds, which is crucial in the development of complex organic molecules. Overall, this compound serves as an important reagent in modern synthetic chemistry, particularly in the fields of pharmaceuticals and materials science.

Formula: C₈H₆BrNZn

InChI: InChI=1/C8H6N.BrH.Zn/c1-7-3-2-4-8(5-7)6-9;;/h2-5H,1H2;1H;/q;;+1/p-1/rC8H6BrNZn/c9-11-6-8-3-1-2-7(4-8)5-10/h1-4H,6H2

InChI key: InChIKey=GGUNXSWBXYMLJE-UHFFFAOYSA-M

SMILES: C([Zn]Br)C1=CC(C#N)=CC=C1

Synonyms:

• Zinc, bromo[(3-cyanophenyl)methyl]-
• (3-Cyanobenzyl)zinc bromide
• Benzonitrile, 3-methyl-, zinc complex
• Bromo[(3-cyanophenyl)methyl]zinc
• (3-cyanobenzyl)zinc(II) broMide
• 3-Cyanobenzylzinc bromide solution 0.5 M in THF
• 3-CYANOBENZYLZINC BROMIDE, 0.5M SOLUTION IN TETRAHYDROFURAN
• 3-cyanobenzylzinc bromide solution
• 3-CYANOBENZYLZINC BROMIDE
• 3-Cyanobenzylzinc bromide 0.5 M in Tetrahydrofuran

3-Cyanobenzylzinc bromide

CAS: 117269-72-4

Formula: C₈H₆BrNZn

Molecular weight: 261.4239

Ref: IN-DA000E14