1,3-Butanedione, 4,4,4-trifluoro-1-[4-(methylthio)phenyl]-

Base Information

Chemical Name:1,3-Butanedione, 4,4,4-trifluoro-1-[4-(methylthio)phenyl]-
CAS No.:134731-32-1
Molecular Formula:C11H9F3O2S
Molecular Weight:262.252
Hs Code.:
DSSTox Substance ID:DTXSID50444112
Wikidata:Q82262128
Mol file:134731-32-1.mol

Synonyms:134731-32-1;1,3-Butanedione, 4,4,4-trifluoro-1-[4-(methylthio)phenyl]-;4,4,4-Trifluoro-1-(4-(methylthio)phenyl)butane-1,3-dione;4,4,4-trifluoro-1-[4-(methylthio)phenyl]butane-1,3-dione;SCHEMBL4032443;DTXSID50444112;AKOS000210794;1-[4-(methylthio)phenyl]-4,4,4-trifluorobutane-1,3-dione;4,4,4-trifluoro-(4-methylsulfanylphenyl)-butane-1,3-dione;4,4,4-trifluoro-1-[4-(methylthio)phenyl]butane-1,3dione

Suppliers and Price of 1,3-Butanedione, 4,4,4-trifluoro-1-[4-(methylthio)phenyl]-

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 2 raw suppliers

Chemical Property of 1,3-Butanedione, 4,4,4-trifluoro-1-[4-(methylthio)phenyl]-

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:262.02753519
Heavy Atom Count:17
Complexity:294

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:CSC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F

Technology Process of 1,3-Butanedione, 4,4,4-trifluoro-1-[4-(methylthio)phenyl]-

There total 2 articles about 1,3-Butanedione, 4,4,4-trifluoro-1-[4-(methylthio)phenyl]- 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: 92.0%

: 383-63-1
ethyl trifluoroacetate,

: 1778-09-2
4-(Methylthio)acetophenone

: 134731-32-1
1-[4-(methylthio)phenyl]-4,4,4-trifluorobutane-1,3-dione

Guidance literature:: With sodium methylate; In methanol; diethyl ether; at 20 ℃; for 18h;
DOI:10.1039/c3ob41935e

Reference yield: 71.0%

: 68099-10-5
4’-methylthioacetophenone

: 383-63-1
ethyl trifluoroacetate,

: 134731-32-1
1-[4-(methylthio)phenyl]-4,4,4-trifluorobutane-1,3-dione

Guidance literature:: ethyl trifluoroacetate,; With tert-butyl methyl ether; sodium methylate; In methanol;

4’-methylthioacetophenone; at 20 ℃;