5-(Methylsulfanyl)-3-phenyl-1,2,4-triazin-6(1H)-one

Base Information

Chemical Name:5-(Methylsulfanyl)-3-phenyl-1,2,4-triazin-6(1H)-one
CAS No.:89730-87-0
Molecular Formula:C₁₀H₉N₃OS
Molecular Weight:219.267
Hs Code.:
DSSTox Substance ID:DTXSID20575149
Wikidata:Q82464409

Synonyms:89730-87-0;5-(Methylsulfanyl)-3-phenyl-1,2,4-triazin-6(1H)-one;DTXSID20575149

Suppliers and Price of 5-(Methylsulfanyl)-3-phenyl-1,2,4-triazin-6(1H)-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 5-(Methylsulfanyl)-3-phenyl-1,2,4-triazin-6(1H)-one

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:219.04663309
Heavy Atom Count:15
Complexity:319

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CSC1=NC(=NNC1=O)C2=CC=CC=C2

Technology Process of 5-(Methylsulfanyl)-3-phenyl-1,2,4-triazin-6(1H)-one

There total 4 articles about 5-(Methylsulfanyl)-3-phenyl-1,2,4-triazin-6(1H)-one 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: 38.0%

: 86958-23-8
5-(Methylthio)-3-phenyl-1,2,4-triazin-6-amin

: 89730-87-0
5-Methylthio-3-phenyl-1,2,4-triazin-6(1H)-on

Guidance literature:: With chloroformic acid ethyl ester; In ethanol; for 24h; Ambient temperature;

Reference yield:

: 89730-53-0
6-Amino-5-oxo-3-phenyl-2,5-dihydro-1,2,4-triazine

: 89730-87-0
5-Methylthio-3-phenyl-1,2,4-triazin-6(1H)-on

Guidance literature:: Multi-step reaction with 3 steps

1: 80 percent / P₂S₅ / dioxane / 1.5 h / Heating

2: 56 percent / 2 N NaOH / H₂O / 72 h

3: 38 percent / ethyl chloroformiate / ethanol / 24 h / Ambient temperature

With sodium hydroxide; tetraphosphorus decasulfide; chloroformic acid ethyl ester; In 1,4-dioxane; ethanol; water;

Reference yield:

: 89730-60-9
6-Amino-5-thioxo-3-phenyl-2,5-dihydro-1,2,4-triazin

: 89730-87-0
5-Methylthio-3-phenyl-1,2,4-triazin-6(1H)-on

Guidance literature:: Multi-step reaction with 2 steps

1: 56 percent / 2 N NaOH / H₂O / 72 h

2: 38 percent / ethyl chloroformiate / ethanol / 24 h / Ambient temperature

With sodium hydroxide; chloroformic acid ethyl ester; In ethanol; water;