5-Cyano-2-methyl-6-phenyl-4-thioxo-3,4-dihydropyrimidine

Base Information

Chemical Name:5-Cyano-2-methyl-6-phenyl-4-thioxo-3,4-dihydropyrimidine
CAS No.:13996-07-1
Molecular Formula:C₁₂H₉N₃S
Molecular Weight:227.29
Hs Code.:
DSSTox Substance ID:DTXSID00418787
Nikkaji Number:J610.099F
Mol file:13996-07-1.mol

Synonyms:13996-07-1;5-Cyano-2-methyl-6-phenyl-4-thioxo-3,4-dihydropyrimidine;2-Methyl-6-phenyl-4-thioxo-1,4-dihydropyrimidine-5-carbonitrile;AC1NTA8W;DTXSID00418787;XZABCLSHFJAYMO-UHFFFAOYSA-N;2-Methyl-4-phenyl-6-thioxo-1,6-dihydro-5-pyrimidinecarbonitrile #

Suppliers and Price of 5-Cyano-2-methyl-6-phenyl-4-thioxo-3,4-dihydropyrimidine

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 0 raw suppliers

Chemical Property of 5-Cyano-2-methyl-6-phenyl-4-thioxo-3,4-dihydropyrimidine

Chemical Property:

XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:227.05171847
Heavy Atom Count:16
Complexity:419

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NC(=S)C(=C(N1)C2=CC=CC=C2)C#N

Technology Process of 5-Cyano-2-methyl-6-phenyl-4-thioxo-3,4-dihydropyrimidine

There total 1 articles about 5-Cyano-2-methyl-6-phenyl-4-thioxo-3,4-dihydropyrimidine 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:

: 13996-07-1
2-Methyl-6-phenyl-4-thioxo-3,4-dihydro-3H-pyrimidin-5-carbonitril

Guidance literature:: N-(β-Amino-α-cyan-thiocinnamoyl)-acetamid; Cyclisier.;

Reference yield: 58.0%

: 13996-07-1
2-Methyl-6-phenyl-4-thioxo-3,4-dihydro-3H-pyrimidin-5-carbonitril

: 142076-88-8
4-Chlor-2-methyl-6-phenylpyrimidin-5-carbonitril

Guidance literature:: With phosphorus pentachloride; trichlorophosphate; for 5h; to 80 deg C;
DOI:10.1002/ardp.19923250506

Reference yield:

: 13996-07-1
2-Methyl-6-phenyl-4-thioxo-3,4-dihydro-3H-pyrimidin-5-carbonitril

: 142386-61-6
Kalium-N-(2-methyl-6-phenyl-5-cyanpyrimidin-4-yl)cyanamid

Guidance literature:: Multi-step reaction with 2 steps

1: 58 percent / PCl₅, POCl₃ / 5 h / to 80 deg C

2: 63 percent / methanol / Heating

With phosphorus pentachloride; trichlorophosphate; In methanol;
DOI:10.1002/ardp.19923250506