5-Pyrimidinecarbonitrile, 4-amino-2,6-bis(methylthio)-

Base Information

Chemical Name:5-Pyrimidinecarbonitrile, 4-amino-2,6-bis(methylthio)-
CAS No.:98277-53-3
Molecular Formula:C7H8N4S2
Molecular Weight:212.29500
Hs Code.:
DSSTox Substance ID:DTXSID10356227
Nikkaji Number:J1.983.051I
Wikidata:Q82135467

Synonyms:98277-53-3;5-Pyrimidinecarbonitrile, 4-amino-2,6-bis(methylthio)-;4-Amino-2,6-bis(methylthio)pyrimidine-5-carbonitrile;4-amino-2,6-bis(methylsulfanyl)pyrimidine-5-carbonitrile;4-amino-2,6-dimethylthiopyrimidine-5-carbonitrile;4-amino-2,6-bis(methylsulfanyl)-5-pyrimidinecarbonitrile;DTXSID10356227;AP-782/41543565

Suppliers and Price of 5-Pyrimidinecarbonitrile, 4-amino-2,6-bis(methylthio)-

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 3 raw suppliers

Chemical Property of 5-Pyrimidinecarbonitrile, 4-amino-2,6-bis(methylthio)-

Chemical Property:

PSA：126.19000
LogP:1.95548
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:212.01903862
Heavy Atom Count:13
Complexity:214

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1=NC(=NC(=C1C#N)N)SC

Technology Process of 5-Pyrimidinecarbonitrile, 4-amino-2,6-bis(methylthio)-

There total 2 articles about 5-Pyrimidinecarbonitrile, 4-amino-2,6-bis(methylthio)- 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: 89.0%

: 867-44-7,147895-43-0
S-Methylisothiourea sulfate

: 5147-80-8
[Bis(methylthio)methylene]malononitrile

: 98277-53-3
4-amino-5-cyano-2,6-dimethylthio-pyrimidine

Guidance literature:: With potassium fluoride on basic alumina; In acetonitrile; for 1h; Heating;
DOI:10.1081/SCC-120026325

Reference yield:

: 5147-80-8
[Bis(methylthio)methylene]malononitrile

: 98277-53-3
4-amino-5-cyano-2,6-dimethylthio-pyrimidine

Guidance literature:: With sodium methylate;
DOI:10.1021/ja01544a058

Reference yield:

: 98277-53-3
4-amino-5-cyano-2,6-dimethylthio-pyrimidine

: 122-51-0
orthoformic acid triethyl ester

: 4664-55-5
phenoxyacetyl hydrazine

: 2-methylthio-4-amino-6-methylthio[3-(phenoxymethyl)-1H-1,2,4-triazol-5-yl]pyrimidine

Guidance literature:: 4-amino-5-cyano-2,6-dimethylthio-pyrimidine; orthoformic acid triethyl ester; With trifluoroacetic acid; for 12h; pH=2; Reflux;

phenoxyacetyl hydrazine; With trifluoroacetic acid; In 1,2-dimethoxyethane; for 8h; pH=7; Reflux;