5-Methyl-2,4-diphenyl-2,4-dihydro-[1,2,4]triazole-3-thione

Base Information

Chemical Name:5-Methyl-2,4-diphenyl-2,4-dihydro-[1,2,4]triazole-3-thione
CAS No.:13136-33-9
Molecular Formula:C15H13N3S
Molecular Weight:267.354
Hs Code.:
DSSTox Substance ID:DTXSID80349525
Nikkaji Number:J433.390J
Wikidata:Q82124844
ChEMBL ID:CHEMBL1579822

Synonyms:5-Methyl-2,4-diphenyl-2,4-dihydro-[1,2,4]triazole-3-thione;5-methyl-2,4-diphenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione;5-METHYL-2,4-DIPHENYL-2,4-DIHYDRO-(1,2,4)TRIAZOLE-3-THIONE;13136-33-9;ST007594;MLS000071881;SCHEMBL8605851;CHEMBL1579822;DTXSID80349525;HMS2303P16;STK792952;AKOS001716997;SMR000009129;SR-01000516428;SR-01000516428-1

Suppliers and Price of 5-Methyl-2,4-diphenyl-2,4-dihydro-[1,2,4]triazole-3-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
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price

Total 1 raw suppliers

Chemical Property of 5-Methyl-2,4-diphenyl-2,4-dihydro-[1,2,4]triazole-3-thione

Chemical Property:

XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:267.08301860
Heavy Atom Count:19
Complexity:368

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=NN(C(=S)N1C2=CC=CC=C2)C3=CC=CC=C3

Technology Process of 5-Methyl-2,4-diphenyl-2,4-dihydro-[1,2,4]triazole-3-thione

There total 9 articles about 5-Methyl-2,4-diphenyl-2,4-dihydro-[1,2,4]triazole-3-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: 86.0%

: 120318-43-6
acetaldehyde 2,4-diphenylthiosemicarbazone

: 13136-33-9
2,4-dihydro-5-methyl-2,4-diphenyl-3H-1,2,4-triazolethione

Guidance literature:: With iron(III) chloride; In ethanol; for 0.0833333h; Heating;

Reference yield: 57.0%

: 103-72-0
phenyl isothiocyanate

: 114-83-0
1-acetyl-2-phenylhydrazine

: 13136-33-9
2,4-dihydro-5-methyl-2,4-diphenyl-3H-1,2,4-triazolethione

Guidance literature:: With potassium hydroxide; In ethanol; at 20 ℃; for 0.75h;
DOI:10.1039/c9ob02258a

Reference yield:

: 13207-47-1
2,4-diphenyl-thiosemicarbazide

: 13136-33-9
2,4-dihydro-5-methyl-2,4-diphenyl-3H-1,2,4-triazolethione

Guidance literature:: Multi-step reaction with 2 steps

1: 43 percent / acetic acid / tetrahydrofuran

2: 86 percent / FeCl₃ / ethanol / 0.08 h / Heating

With iron(III) chloride; acetic acid; In tetrahydrofuran; ethanol;