NAVIGATION


Isobutylzinc bromide solution

Catalog NumberACM126403676-1

CAS Number126403-67-6

CategorySalt

Isobutylzinc bromide solution
IUPAC Name
bromozinc(1+);2-methanidylpropane
Molecular Weight
202.4g/mol
Molecular Formula
C4H9BrZn
Canonical SMILES
CC(C)[CH2-].[Zn+]Br
InChI
InChI=1S/C4H9.BrH.Zn/c1-4(2)3;;/h4H,1H2,2-3H3;1H;/q-1;;+2/p-1
InChI Key
DSDCDMKASWVZHI-UHFFFAOYSA-M
Application
The isobutylzinc bromide solution serves as a versatile reagent in synthetic chemistry, primarily used in the palladium-catalyzed Negishi cross-coupling reaction to form carbon-carbon bonds by interacting with aryl or heteroaryl halides. Additionally, it is instrumental in the preparation of regioselective unsaturated ketones through an allylic carbonylative coupling reaction with tert-butyl isocyanide, facilitated by a nickel catalyst.
Complexity
15
Covalently-Bonded Unit Count
2
Exact Mass
199.9179g/mol
Formal Charge
0
Heavy Atom Count
6
Monoisotopic Mass
199.9179g/mol
Rotatable Bond Count
0
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