1,3-Diphenyl-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole

Base Information

Chemical Name:1,3-Diphenyl-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole
CAS No.:89804-61-5
Molecular Formula:C21H14F3N3
Molecular Weight:365.357
Hs Code.:
DSSTox Substance ID:DTXSID90523935
Wikidata:Q82390388

Synonyms:89804-61-5;DTXSID90523935;1,3-Diphenyl-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole

Suppliers and Price of 1,3-Diphenyl-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 0 raw suppliers

Chemical Property of 1,3-Diphenyl-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole

Chemical Property:

XLogP3:5.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:365.11398195
Heavy Atom Count:27
Complexity:464

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C2=NN(C(=N2)C3=CC=C(C=C3)C(F)(F)F)C4=CC=CC=C4

Technology Process of 1,3-Diphenyl-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole

There total 6 articles about 1,3-Diphenyl-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazole 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: 86.0%

: 59-88-1
phenylhydrazine hydrochloride

: 89804-55-7
N-(phenylthioxomethyl)-4-(trifluoromethyl)benzamide

: 89804-61-5
1,3-Diphenyl-5-(4-trifluoromethyl-phenyl)-1H-[1,2,4]triazole

Guidance literature:: With sodium acetate; In 1,4-dioxane; acetic acid; at 90 ℃;

Reference yield: 70.0%

: 3300-51-4
p-Trifluoromethylbenzylamine

: 588-64-7
(E)-1-benzylidene-2-phenylhydrazine

: 89804-61-5
1,3-Diphenyl-5-(4-trifluoromethyl-phenyl)-1H-[1,2,4]triazole

Guidance literature:: With ferrocene; sodium acetate; tert-butylammonium hexafluorophosphate(V); In 1,2-dichloro-ethane; at 55 ℃; for 11.5h; Electrolysis; Inert atmosphere; Green chemistry;
DOI:10.1002/open.202100268

Reference yield:

: 100-63-0
phenylhydrazine

: 89804-61-5
1,3-Diphenyl-5-(4-trifluoromethyl-phenyl)-1H-[1,2,4]triazole

Guidance literature:: Multi-step reaction with 2 steps

1: sodium acetate; tert-butylammonium hexafluorophosphate(V); ferrocene / 1,2-dichloro-ethane / 1 h / 55 °C / Inert atmosphere

2: sodium acetate; tert-butylammonium hexafluorophosphate(V); ferrocene / 1,2-dichloro-ethane / 11.5 h / 55 °C / Electrolysis; Inert atmosphere; Green chemistry

With ferrocene; sodium acetate; tert-butylammonium hexafluorophosphate(V); In 1,2-dichloro-ethane;
DOI:10.1002/open.202100268