Bromozinc(1+);pentanenitrile

Base Information

Chemical Name:Bromozinc(1+);pentanenitrile
CAS No.:226570-68-9
Molecular Formula:C5H8 Br N Zn
Molecular Weight:227.419
Hs Code.:29319090
DSSTox Substance ID:DTXSID00402843
Mol file:226570-68-9.mol

Synonyms:226570-68-9;bromozinc(1+);pentanenitrile;4-Cyanobutylzinc bromide 0.5 M in Tetrahydrofuran;DTXSID00402843;BJA57068;J-014801

Suppliers and Price of Bromozinc(1+);pentanenitrile

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Sigma-Aldrich
4-Cyanobutylzinc bromide solution 0.5 M in THF
50ml
$ 270.00

Rieke Metals
4-Cyanobutylzincbromide
100mL
$ 499.00

Rieke Metals
4-Cyanobutylzincbromide
50mL
$ 321.00

American Custom Chemicals Corporation
4-CYANOBUTYLZINC BROMIDE 95.00%
1L
$ 7710.00

American Custom Chemicals Corporation
4-CYANOBUTYLZINC BROMIDE 95.00%
500ML
$ 4055.00

American Custom Chemicals Corporation
4-CYANOBUTYLZINC BROMIDE 95.00%
100ML
$ 1131.00

American Custom Chemicals Corporation
4-CYANOBUTYLZINC BROMIDE 95.00%
50ML
$ 850.00

Alfa Aesar
4-Cyanobutylzinc bromide, 0.5M in THF, packaged under Argon in resealable ChemSeal? bottles
50ml
$ 227.00

Total 10 raw suppliers

Chemical Property of Bromozinc(1+);pentanenitrile

Chemical Property:

Vapor Pressure:5.79mmHg at 25°C
Boiling Point:141.7°C at 760 mmHg
Flash Point:40.6°C
PSA：23.79000
Density:0.971 g/mL at 25 °C
LogP:2.49098
Storage Temp.:2-8°C
Sensitive.:Air Sensitive
Water Solubility.:Reacts with water.
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:224.91315
Heavy Atom Count:8
Complexity:59.6

Purity/Quality:

98%,99%, ^*data from raw suppliers

4-Cyanobutylzinc bromide solution 0.5 M in THF ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:F,Xn
Statements: 14-19-22-36/38-40-36/37
Safety Statements: 16-26-33-36-36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:[CH2-]CCCC#N.[Zn+]Br
Uses 4-Cyanobutylzinc bromide is an organozinc compound, which can be used as a reactant in palladium-catalyzed Negishi cross-coupling reaction to construct carbon-carbon bonds by coupling with organic halides or triflates.It can also be used as a reactant to prepare: 5-(3-Thienyl)pentanenitrile by reacting with 3-bromothiophene in the presence of a nickel catalyst. α-Cyanobutyl vinylphosphonates by palladium-catalyzed Negishi coupling vinylation reaction with α-(pseudo)halo vinylphosphonates.

Technology Process of Bromozinc(1+);pentanenitrile

There total 2 articles about Bromozinc(1+);pentanenitrile which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 5414-21-1
5-bromopentan-1-nitrile

: 7440-66-6
zinc

: 226570-68-9
(4-cyanobutyl)zinc(II) bromide

Guidance literature:: In tetrahydrofuran; byproducts: NC(CH2)3CH3; molar ratio Zn:org. molecule = 2:1, 0°C; centrifugation, detd. by (1)H-NMR spectroscopy;
DOI:10.1021/ja9844478

Reference yield:

: 5414-21-1
5-bromopentan-1-nitrile

: 106-93-4
ethylene dibromide

: 7440-66-6
zinc

: 226570-68-9
(4-cyanobutyl)zinc(II) bromide

Guidance literature:: ethylene dibromide; zinc; With lithium chloride; In tetrahydrofuran; at 85 ℃; for 0.5h; Inert atmosphere;

With chloro-trimethyl-silane; iodine; In tetrahydrofuran; for 0.333333h; Inert atmosphere; Reflux;

5-bromopentan-1-nitrile; In tetrahydrofuran; at 65 ℃; Inert atmosphere;
DOI:10.1021/acs.orglett.0c02515