5-(4-Fluorophenyl)-4-((4-nitrobenzylidene)amino)-4H-1,2,4-triazole-3-thiol

Base Information

Chemical Name:5-(4-Fluorophenyl)-4-((4-nitrobenzylidene)amino)-4H-1,2,4-triazole-3-thiol
CAS No.:573950-93-3
Molecular Formula:C₁₅H₁₀FN₅O₂S
Molecular Weight:343.341
Hs Code.:
European Community (EC) Number:643-799-7

Synonyms:STL003434;STL050327;AKOS005703251;AKOS024320234;573950-93-3;5-(4-Fluorophenyl)-4-((4-nitrobenzylidene)amino)-4H-1,2,4-triazole-3-thiol;5-(4-fluorophenyl)-4-{[(E)-(4-nitrophenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol;5-(4-fluorophenyl)-4-{[(E)-(4-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione;5-(4-fluorophenyl)-4-{[(E)-(4-nitrophenyl)methylidene]amino}-4H-1,2,4-triazol-3-yl hydrosulfide

Suppliers and Price of 5-(4-Fluorophenyl)-4-((4-nitrobenzylidene)amino)-4H-1,2,4-triazole-3-thiol

Supply Marketing:

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

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Chemical Property of 5-(4-Fluorophenyl)-4-((4-nitrobenzylidene)amino)-4H-1,2,4-triazole-3-thiol

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:343.05392391
Heavy Atom Count:24
Complexity:549

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1C=NN2C(=NNC2=S)C3=CC=C(C=C3)F)[N+](=O)[O-]
Isomeric SMILES:C1=CC(=CC=C1/C=N/N2C(=NNC2=S)C3=CC=C(C=C3)F)[N+](=O)[O-]

Technology Process of 5-(4-Fluorophenyl)-4-((4-nitrobenzylidene)amino)-4H-1,2,4-triazole-3-thiol

There total 5 articles about 5-(4-Fluorophenyl)-4-((4-nitrobenzylidene)amino)-4H-1,2,4-triazole-3-thiol 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:

: 555-16-8
4-nitrobenzaldehdye

: 61019-25-8
4-amino-5-(3-fiuorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thiol

: 573950-93-3
4-(4-nitrobenzylideneamino)-5-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol

Guidance literature:: In ethanol; at 80 ℃; for 6h;
DOI:10.1016/j.saa.2011.05.068

Reference yield:

: 456-22-4
4-Fluorobenzoic acid

: 573950-93-3
4-(4-nitrobenzylideneamino)-5-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol

Guidance literature:: Multi-step reaction with 5 steps

1: sulfuric acid

2: hydrazine hydrate

3: ammonia / ethanol; water / 0 - 20 °C

4: hydrazine hydrate / ethanol; water / 2 h / 90 °C

5: ethanol / 6 h / 80 °C

With sulfuric acid; ammonia; hydrazine hydrate; In ethanol; water;
DOI:10.1016/j.saa.2011.05.068

Reference yield:

: 456-06-4
4-fluorobenzoyl hydrazide

: 573950-93-3
4-(4-nitrobenzylideneamino)-5-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol

Guidance literature:: Multi-step reaction with 3 steps

1: ammonia / ethanol; water / 0 - 20 °C

2: hydrazine hydrate / ethanol; water / 2 h / 90 °C

3: ethanol / 6 h / 80 °C

With ammonia; hydrazine hydrate; In ethanol; water;
DOI:10.1016/j.saa.2011.05.068