5-(Methylthio)-6-azauracil

Base Information

• Chemical Name: 5-(Methylthio)-6-azauracil
• CAS No.: 31697-20-8
• Molecular Formula: C₄H₅N₃O₂S
• Molecular Weight: 159.169
• Hs Code.: 2933699090
• NSC Number: 118348
• DSSTox Substance ID: DTXSID80297815
• Wikidata: Q82039237
• Mol file: 31697-20-8.mol

Synonyms:5-(methylthio)-6-azauracil;31697-20-8;6-methylsulfanyl-2H-1,2,4-triazine-3,5-dione;6-(Methylthio)-1,2,4-triazine-3,5(2H,4H)-dione;NSC118348;SCHEMBL6249076;DTXSID80297815;STL325574;AKOS006230645;NSC-118348;FT-0692635;6-(methylsulfanyl)-1,2,4-triazine-3,5(2H,4H)-dione

Chemical Property of 5-(Methylthio)-6-azauracil

Chemical Property:

• Refractive Index: 1.75
• PSA: 103.91000
• Density: 1.75 g/cm³
• LogP: -0.81990
• XLogP3: 0
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 159.01024758
• Heavy Atom Count: 10
• Complexity: 213

Purity/Quality:

99% ^*data from raw suppliers

5-(METHYLTHIO)-6-AZAURACIL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1=NNC(=O)NC1=O

Technology Process of 5-(Methylthio)-6-azauracil

There total 2 articles about 5-(Methylthio)-6-azauracil 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:

→ 6-methylsulfanyl-2H-[1,2,4]triazine-3,5-dione (31697-20-8)

Guidance literature:

DOI:10.1021/jm00214a003

Reference yield:

→ 3.5-Dihydroxy-6-methylmercapto-1.2.4-triazin (31697-20-8)

Guidance literature:

3.5-Dihydroxy-6-mercapto-1.2.4-triazin-dinatriumsalz , W. , Methyljodid , ( 18grad , 1h );