4-(2-chlorophenyl)-5-methyl-4H-1,2,4-triazole-3-thiol

Base Information

Chemical Name:4-(2-chlorophenyl)-5-methyl-4H-1,2,4-triazole-3-thiol
CAS No.:52747-59-8
Molecular Formula:C9H8ClN3S
Molecular Weight:225.702
Hs Code.:
DSSTox Substance ID:DTXSID00480469
Wikidata:Q82315251

Synonyms:52747-59-8;4-(2-chlorophenyl)-5-methyl-4H-1,2,4-triazole-3-thiol;4-(2-chlorophenyl)-3-methyl-1H-1,2,4-triazole-5-thione;ST50848030;SCHEMBL11538155;DTXSID00480469;AKOS003321753

Suppliers and Price of 4-(2-chlorophenyl)-5-methyl-4H-1,2,4-triazole-3-thiol

Supply Marketing:

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

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of 4-(2-chlorophenyl)-5-methyl-4H-1,2,4-triazole-3-thiol

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:225.0127461
Heavy Atom Count:14
Complexity:279

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NNC(=S)N1C2=CC=CC=C2Cl

Technology Process of 4-(2-chlorophenyl)-5-methyl-4H-1,2,4-triazole-3-thiol

There total 5 articles about 4-(2-chlorophenyl)-5-methyl-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: 93.0%

: 52747-50-9
1-acetyl-4-(2-chlorophenyl)thiosemicarbazide

: 52747-59-8
4-(2-chlorophenyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Guidance literature:: With sodium hydroxide; Reflux;
DOI:10.1080/10426507.2014.902831

Reference yield:

: 2740-81-0
2-chlorophenylisothiocyanate

: 52747-59-8
4-(2-chlorophenyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol / Reflux

2: sodium hydroxide / Reflux

With sodium hydroxide; In ethanol;
DOI:10.1080/10426507.2014.902831