3-Methyl-5,6-diphenyl-1,2,4-triazine

Base Information

• Chemical Name: 3-Methyl-5,6-diphenyl-1,2,4-triazine
• CAS No.: 24108-37-0
• Molecular Formula: C16H13 N3
• Molecular Weight: 247.299
• NSC Number: 172291
• DSSTox Substance ID: DTXSID50305875
• Nikkaji Number: J510.431I
• Wikidata: Q82052656
• Mol file: 24108-37-0.mol

Synonyms:3-methyl-5,6-diphenyl-1,2,4-triazine;24108-37-0;NSC172291;SCHEMBL12112372;DTXSID50305875;AKOS024344898;NSC-172291;1,4-Triazine, 3-methyl-5,6-diphenyl-;3-methyl-5,6-diphenyl-[1,2,4]triazine

Chemical Property of 3-Methyl-5,6-diphenyl-1,2,4-triazine

Chemical Property:

• Vapor Pressure: 6.7E-07mmHg at 25°C
• Boiling Point: 420.8°Cat760mmHg
• Flash Point: 189.7°C
• Density: 1.145g/cm³
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 247.110947427
• Heavy Atom Count: 19
• Complexity: 269

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3

Technology Process of 3-Methyl-5,6-diphenyl-1,2,4-triazine

There total 7 articles about 3-Methyl-5,6-diphenyl-1,2,4-triazine 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: 70.0%

6-methyl-3-phenyl-1,2,4,5-tetrazine (38634-12-7) + benzamidin (618-39-3) → 3-methyl-5,6-diphenyl-1,2,4-triazine (24108-37-0)

Guidance literature:

In toluene; Mechanism; Heating;

DOI:10.1016/S0040-4039(01)90330-2

Reference yield: 7.0%

6-methyl-3-phenyl-1,2,4,5-tetrazine (38634-12-7) + benzamidin (618-39-3) → 3-methyl-5,6-diphenyl-1,2,4-triazine (24108-37-0) + 2,4,6-triphenyl-1,3,5-triazine (493-77-6)

Guidance literature:

In toluene; for 7.5h; Heating;

DOI:10.1016/S0040-4039(01)90330-2

Reference yield:

benzil-mono-acetylhydrazone → 3-methyl-5,6-diphenyl-1,2,4-triazine (24108-37-0)

Guidance literature:

With ethanol; ammonia; at 160 ℃;

upstream raw materials:

6-methyl-3-phenyl-1,2,4,5-tetrazine

benzamidin

benzil

benzil monohydrazone

Downstream raw materials:

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

1-methyl-3,4-diphenyl-6,7-dihydro-5H-cyclopenta[c]pyridine

1-methyl-3,4-diphenylisoquinoline

2,4,6-triphenyl-1,3,5-triazine