Pyrimidine, 2-(methylthio)-4-phenyl-6-(trifluoromethyl)-

Base Information

Chemical Name:Pyrimidine, 2-(methylthio)-4-phenyl-6-(trifluoromethyl)-
CAS No.:2627-52-3
Molecular Formula:C12H9F3N2S
Molecular Weight:270.278
Hs Code.:
DSSTox Substance ID:DTXSID70443824
Nikkaji Number:J829.535B
Wikidata:Q82261783
Mol file:2627-52-3.mol

Synonyms:2627-52-3;Pyrimidine, 2-(methylthio)-4-phenyl-6-(trifluoromethyl)-;2-(Methylthio)-4-phenyl-6-(trifluoromethyl)pyrimidine;2-(methylsulfanyl)-4-phenyl-6-(trifluoromethyl)pyrimidine;DTXSID70443824;PQTKAEIVSMJYCD-UHFFFAOYSA-N;STL289445;AKOS000408465;2-(Methylthio)-4-(trifluoromethyl)-6-phenylpyrimidine

Suppliers and Price of Pyrimidine, 2-(methylthio)-4-phenyl-6-(trifluoromethyl)-

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
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price

Total 1 raw suppliers

Chemical Property of Pyrimidine, 2-(methylthio)-4-phenyl-6-(trifluoromethyl)-

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:270.04385396
Heavy Atom Count:18
Complexity:267

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1=NC(=CC(=N1)C(F)(F)F)C2=CC=CC=C2

Technology Process of Pyrimidine, 2-(methylthio)-4-phenyl-6-(trifluoromethyl)-

There total 7 articles about Pyrimidine, 2-(methylthio)-4-phenyl-6-(trifluoromethyl)- 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: 91.0%

: 191341-06-7
2-methylthio-4-trifluoromethyl-4-iodopyrimidine

: 98-80-6
phenylboronic acid

: 2627-52-3
2-(methylthio)-4-phenyl-6-(trifluoromethyl)pyrimidine

Guidance literature:: With tetrakis(triphenylphosphine) palladium⁽⁰⁾; potassium carbonate; In ethanol; toluene; at 85 ℃; for 4h;

Reference yield: 76.0%

: 147895-43-0
S-methylisothiourea hemisulphate

: 326-06-7
1-Phenyl-4,4,4-trifluorobutane-1,3-dione

: 2627-52-3
2-(methylthio)-4-phenyl-6-(trifluoromethyl)pyrimidine

Guidance literature:: With sodium acetate; acetic acid; for 4h; Inert atmosphere; Reflux;
DOI:10.1016/j.ejmech.2021.113809

Reference yield: 76.0%

: 2-(methylthio)-6-(trifluoromethyl)pyrimidin-4-yl trifluoromethane sulfonate

: 98-80-6
phenylboronic acid

: 2627-52-3
2-(methylthio)-4-phenyl-6-(trifluoromethyl)pyrimidine

Guidance literature:: With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; sodium carbonate; In 1,4-dioxane; water; Inert atmosphere; Heating;
DOI:10.1021/acsmedchemlett.6b00489