4-Bromo-3,3-dimethylbutanenitrile

Base Information

Chemical Name:4-Bromo-3,3-dimethylbutanenitrile
CAS No.:129415-93-6
Molecular Formula:C₆H₁₀BrN
Molecular Weight:176.056
Hs Code.:
European Community (EC) Number:863-137-2
DSSTox Substance ID:DTXSID601298751
Mol file:129415-93-6.mol

Synonyms:4-bromo-3,3-dimethylbutanenitrile;129415-93-6;4-BROMO-3,3-DIMETHYLBUTYRONITRILE;SCHEMBL23954507;DTXSID601298751;AKOS006284908;EN300-233401

Suppliers and Price of 4-Bromo-3,3-dimethylbutanenitrile

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

TRC
4-bromo-3,3-dimethylbutanenitrile
50mg
$ 350.00

TRC
4-bromo-3,3-dimethylbutanenitrile
10mg
$ 90.00

TRC
4-bromo-3,3-dimethylbutanenitrile
5mg
$ 65.00

American Custom Chemicals Corporation
4-BROMO-3,3-DIMETHYLBUTYRONITRILE 98.00%
5G
$ 1501.50

AK Scientific
4-Bromo-3,3-dimethylbutanenitrile
100mg
$ 506.00

AK Scientific
4-Bromo-3,3-dimethylbutanenitrile
1g
$ 1275.00

AK Scientific
4-Bromo-3,3-dimethylbutanenitrile
500mg
$ 1016.00

A1 Biochem Labs
4-Hydroxy-3,3-dimethylbutanenitrile 95%
5 g
$ 950.00

A1 Biochem Labs
4-Hydroxy-3,3-dimethylbutanenitrile 95%
1 g
$ 450.00

Total 15 raw suppliers

Chemical Property of 4-Bromo-3,3-dimethylbutanenitrile

Chemical Property:

Boiling Point:222.6±13.0 °C(Predicted)
Density:1.311±0.06 g/cm3(Predicted)
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:174.99966
Heavy Atom Count:8
Complexity:109

Purity/Quality:

99% ^*data from raw suppliers

4-bromo-3,3-dimethylbutanenitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(CC#N)CBr

Technology Process of 4-Bromo-3,3-dimethylbutanenitrile

There total 4 articles about 4-Bromo-3,3-dimethylbutanenitrile 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:

: 129415-92-5
Toluene-4-sulfonic acid 3-cyano-2,2-dimethyl-propyl ester

: 129415-93-6
4-Bromo-3,3-dimethyl-butyronitrile

Guidance literature:: With lithium bromide; In dimethyl sulfoxide; at 120 ℃; for 3h; Yield given;
DOI:10.1016/S0040-4039(00)89002-4

Reference yield:

: 1003-85-6
5.5-dimethyl-1,3,2-dioxathiane-2-oxide

: 129415-93-6
4-Bromo-3,3-dimethyl-butyronitrile

Guidance literature:: Multi-step reaction with 3 steps

1: 66 percent / dimethylsulfoxide / 5 h / 120 °C

2: pyridine / 12 h / 0 °C

3: LiBr / dimethylsulfoxide / 3 h / 120 °C

With pyridine; lithium bromide; In dimethyl sulfoxide;
DOI:10.1016/S0040-4039(00)89002-4

Reference yield:

: 103804-80-4
3,3-dimethyl-4-hydroxy butyronitrile

: 129415-93-6
4-Bromo-3,3-dimethyl-butyronitrile

Guidance literature:: Multi-step reaction with 2 steps

1: pyridine / 12 h / 0 °C

2: LiBr / dimethylsulfoxide / 3 h / 120 °C

With pyridine; lithium bromide; In dimethyl sulfoxide;
DOI:10.1016/S0040-4039(00)89002-4