4-(3,5-Dimethylphenoxy)butanoic acid

Base Information

Chemical Name:4-(3,5-Dimethylphenoxy)butanoic acid
CAS No.:57932-18-0
Molecular Formula:C12H16O3
Molecular Weight:208.257
Hs Code.:
DSSTox Substance ID:DTXSID50364624
Wikidata:Q82148682
ChEMBL ID:CHEMBL1493799

Synonyms:4-(3,5-dimethylphenoxy)butanoic acid;57932-18-0;Butanoic acid, 4-(3,5-dimethylphenoxy)-;SMR000074404;MLS000099619;SCHEMBL2280556;CHEMBL1493799;DTXSID50364624;HMS2304G03;AKOS000103143;CS-0331724;A1-13918

Suppliers and Price of 4-(3,5-Dimethylphenoxy)butanoic acid

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 3 raw suppliers

Chemical Property of 4-(3,5-Dimethylphenoxy)butanoic acid

Chemical Property:

XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:208.109944368
Heavy Atom Count:15
Complexity:193

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=CC(=C1)OCCCC(=O)O)C

Technology Process of 4-(3,5-Dimethylphenoxy)butanoic acid

There total 3 articles about 4-(3,5-Dimethylphenoxy)butanoic acid 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: 82.0%

: 40324-66-1
ethyl 4-(3,5-dimethylphenoxy)butanoate

: 57932-18-0
4-(3,5-dimethylphenoxy)butanoic acid

Guidance literature:: With lithium hydroxide; In tetrahydrofuran; water; at 20 ℃; for 4h;
DOI:10.1021/acs.jmedchem.9b00462

Reference yield:

: 108-68-9,50356-23-5
3,5-Dimethylphenol

: 57932-18-0
4-(3,5-dimethylphenoxy)butanoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: potassium carbonate / N,N-dimethyl-formamide / 16 h / 90 °C

2: lithium hydroxide / water; tetrahydrofuran / 4 h / 20 °C

With potassium carbonate; lithium hydroxide; In tetrahydrofuran; water; N,N-dimethyl-formamide;
DOI:10.1021/acs.jmedchem.9b00462