6-Methyl-1-oxido-4-phenyltriazin-1-ium

Base Information

Chemical Name:6-Methyl-1-oxido-4-phenyltriazin-1-ium
CAS No.:77202-13-2
Molecular Formula:C₁₀H₉N₃O
Molecular Weight:187.201
Hs Code.:
DSSTox Substance ID:DTXSID60506472
Wikidata:Q82362224

Synonyms:77202-13-2;DTXSID60506472;6-Methyl-1-oxo-4-phenyl-1,2,3lambda~5~-triazine

Suppliers and Price of 6-Methyl-1-oxido-4-phenyltriazin-1-ium

Supply Marketing:

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

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Chemical Property of 6-Methyl-1-oxido-4-phenyltriazin-1-ium

Chemical Property:

XLogP3:0.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:187.074561919
Heavy Atom Count:14
Complexity:182

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=NN=[N+]1[O-])C2=CC=CC=C2

Technology Process of 6-Methyl-1-oxido-4-phenyltriazin-1-ium

There total 2 articles about 6-Methyl-1-oxido-4-phenyltriazin-1-ium 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: 29.0%

: 77202-10-9
4-methyl-6-phenyl-1,2,3-triazine

: 77202-17-6
4-Methyl-6-phenyl-[1,2,3]triazine 2-oxide

: 77202-13-2
6-Methyl-4-phenyl-[1,2,3]triazine 1-oxide

Guidance literature:: With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; for 1h; Ambient temperature;
DOI:10.1248/cpb.34.109

Reference yield:

: 77202-05-2
1-amino-5-methyl-3-phenylpyrazole

: 77202-13-2
6-Methyl-4-phenyl-[1,2,3]triazine 1-oxide

Guidance literature:: Multi-step reaction with 2 steps

1: 70 percent / lead tetra-acetate / CH₂Cl₂ / 0 °C

2: 29 percent / m-chloroperbenzoic acid / CH₂Cl₂ / Ambient temperature

With lead(IV) acetate; 3-chloro-benzenecarboperoxoic acid; In dichloromethane;
DOI:10.1039/c39800001182