CAS 308796-14-7 PHENETHYLZINC BROMIDE - Materials / Alfa Chemistry

NAVIGATION

PHENETHYLZINC BROMIDE

PRICE INQUIRY

Catalog Number

ACM308796147-1

CAS Number

308796-14-7

Product Name

PHENETHYLZINC BROMIDE

Structure

Category

Salt

IUPAC Name

bromozinc(1+);ethylbenzene

Molecular Weight

250.4g/mol

Molecular Formula

C8H9BrZn

Canonical SMILES

[CH2-]CC1=CC=CC=C1.[Zn+]Br

InChI

InChI=1S/C8H9.BrH.Zn/c1-2-8-6-4-3-5-7-8;;/h3-7H,1-2H2;1H;/q-1;;+2/p-1

InChI Key

YHVLYRZWQLDARE-UHFFFAOYSA-M

Application

Phenethylzinc bromide serves as a versatile reagent with multiple applications in synthesis. It is employed in transition metal-catalyzed Negishi cross-coupling reactions to facilitate the creation of aryl or heteroaryl derivatives by forming carbon-carbon bonds with organic halides or triflates. Additionally, it can be used in palladium-catalyzed cross-coupling reactions to produce (4-phenyl-1-butyn-1-yl)benzene when reacted with phenylacetylene. Furthermore, phenethylzinc bromide is instrumental in synthesizing benzyl substituted thienopyrimidine derivatives.

Complexity

60.3

Covalently-Bonded Unit Count

Exact Mass

247.9179g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

247.9179g/mol

Rotatable Bond Count

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