4-(4-bromophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione

Base Information

Chemical Name:4-(4-bromophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione
CAS No.:60870-40-8
Molecular Formula:C12H8BrN3OS
Molecular Weight:322.18000
Hs Code.:2934999090
DSSTox Substance ID:DTXSID30357599
Wikidata:Q82137572
ChEMBL ID:CHEMBL1727425
Mol file:60870-40-8.mol

Synonyms:60870-40-8;4-(4-bromophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol;4-(4-bromophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione;MLS001178920;SMR000476469;4-(4-bromophenyl)-5-(2-furyl)-4H-1,2,4-triazol-3-yl hydrosulfide;AJ-292/12333013;ChemDiv1_020638;ChemDiv1_026912;cid_854681;CHEMBL1727425;BDBM80300;HMS645K02;HMS663H06;DTXSID30357599;HMS2795E16;CS-0270932;EN300-111058;AB00095114-01;SR-01000418119;SR-01000418119-1;4-(4-bromophenyl)-3-(2-furyl)-1H-1,2,4-triazole-5-thione;4-(4-bromophenyl)-5-furan-2-yl-4H-[1,2,4]triazole-3-thiol;4-(4-bromophenyl)-3-(2-furanyl)-1H-1,2,4-triazole-5-thione

Suppliers and Price of 4-(4-bromophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione

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

American Custom Chemicals Corporation
4-(4-BROMO-PHENYL)-5-FURAN-2-YL-4H-[1,2,4]TRIAZOLE-3-THIOL 95.00%
100MG
$ 187.95

Total 4 raw suppliers

Chemical Property of 4-(4-bromophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione

Chemical Property:

PSA：82.65000
LogP:3.57850
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:320.95715
Heavy Atom Count:18
Complexity:368

Purity/Quality:

99% ^*data from raw suppliers

4-(4-BROMO-PHENYL)-5-FURAN-2-YL-4H-[1,2,4]TRIAZOLE-3-THIOL 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=COC(=C1)C2=NNC(=S)N2C3=CC=C(C=C3)Br

Technology Process of 4-(4-bromophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione

There total 1 articles about 4-(4-bromophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione 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:

: 60870-40-8
4-(4-Bromo-phenyl)-5-furan-2-yl-4H-[1,2,4]triazole-3-thiol

Guidance literature:

Reference yield: 86.0%

: 60870-40-8
4-(4-Bromo-phenyl)-5-furan-2-yl-4H-[1,2,4]triazole-3-thiol

: 105-36-2
ethyl bromoacetate

: 202867-16-1
ethyl 2-((4-(4-bromophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetate

Guidance literature:: With potassium hydroxide; In ethanol; for 2h; Heating;

Reference yield:

: 60870-40-8
4-(4-Bromo-phenyl)-5-furan-2-yl-4H-[1,2,4]triazole-3-thiol

: 202867-18-3
2-((4-(4-bromophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)aceto hydrazide

Guidance literature:: Multi-step reaction with 2 steps

1: 86 percent / KOH / ethanol / 2 h / Heating

2: 83 percent / hydrazine hydrate / ethanol / 3 h / Heating

With potassium hydroxide; hydrazine hydrate; In ethanol;