Acetic acid, [(4-hydroxyphenyl)thio]-, 1,1-dimethylethyl ester

Base Information

Chemical Name:Acetic acid, [(4-hydroxyphenyl)thio]-, 1,1-dimethylethyl ester
CAS No.:135996-16-6
Molecular Formula:C12H16O3S
Molecular Weight:240.323
Hs Code.:
DSSTox Substance ID:DTXSID90437563
Nikkaji Number:J3.665.745F
Wikidata:Q82253087
Mol file:135996-16-6.mol

Synonyms:135996-16-6;Acetic acid, [(4-hydroxyphenyl)thio]-, 1,1-dimethylethyl ester;SCHEMBL4597724;(4-hydroxy-phenylsulfanyl)-acetic acid tert-butyl ester;DTXSID90437563;WSTKYJOCODCJIS-UHFFFAOYSA-N;AKOS008723086;tert-butyl (4-hydroxyphenylthio)acetate;J3.665.745F;(4-Hydroxyphenylthio)acetic acid tert-butyl ester

Suppliers and Price of Acetic acid, [(4-hydroxyphenyl)thio]-, 1,1-dimethylethyl ester

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 1 raw suppliers

Chemical Property of Acetic acid, [(4-hydroxyphenyl)thio]-, 1,1-dimethylethyl ester

Chemical Property:

XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:240.08201554
Heavy Atom Count:16
Complexity:227

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)CSC1=CC=C(C=C1)O

Technology Process of Acetic acid, [(4-hydroxyphenyl)thio]-, 1,1-dimethylethyl ester

There total 3 articles about Acetic acid, [(4-hydroxyphenyl)thio]-, 1,1-dimethylethyl ester 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: 90.0%

: 5292-43-3
bromoacetic acid tert-butyl ester

: 637-89-8
4-sulfanylphenol

: 135996-16-6
tert-butyl 2-((4-hydroxyphenyl)sulfanyl)acetate

Guidance literature:: With potassium carbonate; at 24 ℃; for 24h;
DOI:10.1002/pola.28945

Reference yield: 87.0%

: 106-41-2
4-bromo-phenol

: 5292-43-3
bromoacetic acid tert-butyl ester

: 135996-16-6
tert-butyl 2-((4-hydroxyphenyl)sulfanyl)acetate

Guidance literature:: 4-bromo-phenol; With tert.-butyl lithium; isopropylmagnesium chloride; In tetrahydrofuran; pentane; at -78 ℃; for 0.5h;

bromoacetic acid tert-butyl ester; With sulfur; at -78 - 20 ℃;
DOI:10.1016/j.tetlet.2006.07.056