1,2,3-Triazine, 5-methyl-

Base Information

• Chemical Name: 1,2,3-Triazine, 5-methyl-
• CAS No.: 86402-30-4
• Molecular Formula: C4H5N3
• Molecular Weight: 95.1038
• DSSTox Substance ID: DTXSID70235524
• Nikkaji Number: J434.119H
• Wikidata: Q83117407

Synonyms:1,2,3-Triazine, 5-methyl-;86402-30-4;5-Methyl-1,2,3-triazine;monomethyltriazine;DTXSID70235524

Chemical Property of 1,2,3-Triazine, 5-methyl-

Chemical Property:

• Vapor Pressure: 0.984mmHg at 25°C
• Boiling Point: 184.8°C at 760 mmHg
• Flash Point: 77.3°C
• Density: 1.113g/cm³
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 95.048347172
• Heavy Atom Count: 7
• Complexity: 48.9

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CN=NN=C1

Technology Process of 1,2,3-Triazine, 5-methyl-

There total 2 articles about 1,2,3-Triazine, 5-methyl- 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: 50.0%

4-Methyl-1H-pyrazol-1-amin (99232-51-6) → 5-methyl-1,2,3-triazine (86402-30-4)

Guidance literature:

With iodine; potassium hydrogencarbonate; In dichloromethane; water; for 0.5h; Ambient temperature;

Reference yield:

4-methyl-1H-pyrazole (7554-65-6) → 5-methyl-1,2,3-triazine (86402-30-4)

Guidance literature:

4-methyl-1H-pyrazole; With sodium hydroxide; hydroxylamine-O-sulfonic acid; In water; at 0 ℃; for 0.5h;

With sodium periodate; In dichloromethane; water; at 0 ℃; for 12h;

DOI:10.1016/j.cclet.2020.03.075

Reference yield: 74.0%

5-methyl-1,2,3-triazine (86402-30-4) + 1-(6-methyl-3-pyridinyl)-2-[4-(methylsulfonyl)phenyl]ethanone (221615-75-4) → 5,6'-dimethyl-3-(4-(methylsulfonyl)phenyl)-2,3'-bipyridine

Guidance literature:

With caesium carbonate; In tetrahydrofuran; at 20 ℃; for 3h;

DOI:10.1016/j.cclet.2020.03.075

upstream raw materials:

4-Methyl-1H-pyrazol-1-amin

4-methyl-1H-pyrazole

Downstream raw materials:

2-amino-3-carbethoxy-5-methylpyridine

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