4,5-Diphenyl-1H-1,2,3-triazol-1-amine

Base Information

• Chemical Name: 4,5-Diphenyl-1H-1,2,3-triazol-1-amine
• CAS No.: 40788-61-2
• Molecular Formula: C₁₄H₁₂N₄
• Molecular Weight: 236.276
• NSC Number: 114497
• DSSTox Substance ID: DTXSID50297145
• Wikidata: Q82038116

Synonyms:40788-61-2;4,5-Diphenyl-1H-1,2,3-triazol-1-amine;NSC114497;SCHEMBL458167;DTXSID50297145;UKKDZCUPSSYZKY-UHFFFAOYSA-N;NSC-114497;4,5-Diphenyl-1H-1,2,3-triazol-1-amine #;1,2,3(1H)-Triazole, 1-amino-4,5-diphenyl-;SR-01000199052;SR-01000199052-1;Z57969843

Chemical Property of 4,5-Diphenyl-1H-1,2,3-triazol-1-amine

Chemical Property:

• Vapor Pressure: 1.94E-07mmHg at 25°C
• Boiling Point: 425.2°Cat760mmHg
• Flash Point: 211°C
• Density: 1.24g/cm³
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 236.106196400
• Heavy Atom Count: 18
• Complexity: 259

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=C(N(N=N2)N)C3=CC=CC=C3

Technology Process of 4,5-Diphenyl-1H-1,2,3-triazol-1-amine

There total 3 articles about 4,5-Diphenyl-1H-1,2,3-triazol-1-amine 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:

4,5-diphenyl-2H-1,2,3-triazole (120106-62-9) → 1-amino-4,5-diphenyl-1,2,3-triazole (40788-61-2) + 2-amino-4,5-diphenyl-1,2,3-triazole

Guidance literature:

With hydroxylamine-O-sulfonic acid; In potassium hydroxide; water; at 60 ℃; for 2h; Yield given. Yields of byproduct given;

DOI:10.1007/BF00810114

Reference yield:

→ 1-amino-4,5-diphenyl-1,2,3-triazole (40788-61-2)

Guidance literature:

With hydrogenchloride;

Reference yield:

→ 1-amino-4,5-diphenyl-1,2,3-triazole (40788-61-2)

Guidance literature:

Verb. 6a, HCl, Hydrolyse;

DOI:10.1246/bcsj.49.2606

upstream raw materials:

4,5-diphenyl-2H-1,2,3-triazole

Downstream raw materials:

1-(N,N-bisacetyl)amino-4,5-diphenyl-1,2,3-triazole

1,2-dibromo-1,2-diphenylethylene

diphenyl acetylene

4,5-Diphenyl-1H-[1,2,3]triazole

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