1-Bromo-4,4-dimethylpentan-2-one

Base Information

Chemical Name:1-Bromo-4,4-dimethylpentan-2-one
CAS No.:4775-69-3
Molecular Formula:C7H13BrO
Molecular Weight:193.084
Hs Code.:
European Community (EC) Number:851-001-5
NSC Number:9058
DSSTox Substance ID:DTXSID30278674
Wikidata:Q82010732
Mol file:4775-69-3.mol

Synonyms:1-bromo-4,4-dimethylpentan-2-one;4775-69-3;1-bromo-4,4-dimethyl-2-pentanone;NSC9058;SCHEMBL841626;DTXSID30278674;NSC 9058;NSC-9058;AKOS017529134;1-bromanyl-4,4-dimethyl-pentan-2-one;CS-0239445;EN300-213076;A830167

Suppliers and Price of 1-Bromo-4,4-dimethylpentan-2-one

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

Total 7 raw suppliers

Chemical Property of 1-Bromo-4,4-dimethylpentan-2-one

Chemical Property:

Vapor Pressure:0.329mmHg at 25°C
Boiling Point:200.2°Cat760mmHg
Flash Point:36.4°C
Density:1.25g/cm³
XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:192.01498
Heavy Atom Count:9
Complexity:102

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)CC(=O)CBr

Technology Process of 1-Bromo-4,4-dimethylpentan-2-one

There total 9 articles about 1-Bromo-4,4-dimethylpentan-2-one 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: 100.0%

: 590-50-1
4,4-dimethyl-pentan-2-one

: 4775-69-3
1-bromo-4,4-dimethylpentan-2-one

Guidance literature:: With bromine; In methanol; at 0 - 20 ℃; for 3h;

Reference yield: 93.0%

: 1271-66-5
dimethyltitanocene

: 26153-90-2
N,N-dimethyl-tert-butylacetamide

: 4775-69-3
1-bromo-4,4-dimethylpentan-2-one

Guidance literature:: dimethyltitanocene; N,N-dimethyl-tert-butylacetamide; In toluene; at 65 ℃; Schlenk technique; Inert atmosphere;

With bromine; In toluene; at -78 ℃; for 0.0333333h; Schlenk technique; Inert atmosphere;

With water; In toluene; at 20 ℃; for 1h; regioselective reaction; Schlenk technique; Inert atmosphere;
DOI:10.1080/00397911.2013.765484

Reference yield: 82.5%

: 7065-46-5
3,3-dimethylbutanoic acid chloride

: 4775-69-3
1-bromo-4,4-dimethylpentan-2-one

Guidance literature:: 3,3-dimethylbutanoic acid chloride; With diazomethyl-trimethyl-silane; In tetrahydrofuran; acetonitrile; for 40h; Heating / reflux;

With hydrogen bromide; In tetrahydrofuran; for 0.5h;