2-(Methylsulfanyl)-4-phenylpyrimidine-5-carbonitrile

Base Information

Chemical Name:2-(Methylsulfanyl)-4-phenylpyrimidine-5-carbonitrile
CAS No.:89079-61-8
Molecular Formula:C12H9N3S
Molecular Weight:227.29
Hs Code.:
DSSTox Substance ID:DTXSID70518925
Wikidata:Q82381788

Synonyms:89079-61-8;2-(Methylthio)-4-phenylpyrimidine-5-carbonitrile;2-(Methylsulfanyl)-4-phenylpyrimidine-5-carbonitrile;SCHEMBL9438517;DTXSID70518925;phenyl-2-(methylthio)-pyrimidine-5-carbonitrile

Suppliers and Price of 2-(Methylsulfanyl)-4-phenylpyrimidine-5-carbonitrile

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 2-(Methylsulfanyl)-4-phenylpyrimidine-5-carbonitrile

Chemical Property:

XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:227.05171847
Heavy Atom Count:16
Complexity:267

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=NC=C(C(=N1)C2=CC=CC=C2)C#N

Technology Process of 2-(Methylsulfanyl)-4-phenylpyrimidine-5-carbonitrile

There total 4 articles about 2-(Methylsulfanyl)-4-phenylpyrimidine-5-carbonitrile 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: 67.0%

: 89079-59-4
5-cyano-2-methylthio-4-phenyl-3,4-dihydropyrimidine

: 89079-61-8
5-cyano-2-methylthio-4-phenylpyrimidine

Guidance literature:: With 2,3-dicyano-5,6-dichloro-p-benzoquinone; In benzene; for 0.166667h;

Reference yield:

: phenylmagnesium iodide

: 89079-61-8
5-cyano-2-methylthio-4-phenylpyrimidine

Guidance literature:: Multi-step reaction with 2 steps

1: 60 percent / diethyl ether / 0.17 h / Ambient temperature

2: 67 percent / 2,3-dichloro-5,6-dicyanobenzoquinone / benzene / 0.17 h

With 2,3-dicyano-5,6-dichloro-p-benzoquinone; In diethyl ether; benzene;

Reference yield:

: 38275-43-3
2-(methylsulfanyl)pyrimidine-5-carbonitrile

: 89079-61-8
5-cyano-2-methylthio-4-phenylpyrimidine

Guidance literature:: Multi-step reaction with 2 steps

1: 60 percent / diethyl ether / 0.17 h / Ambient temperature

2: 67 percent / 2,3-dichloro-5,6-dicyanobenzoquinone / benzene / 0.17 h

With 2,3-dicyano-5,6-dichloro-p-benzoquinone; In diethyl ether; benzene;