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

Base Information

Chemical Name:5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
CAS No.:26131-64-6
Molecular Formula:C10H10 Cl N3 S
Molecular Weight:239.728
Hs Code.:2933990090
DSSTox Substance ID:DTXSID10352446
Wikidata:Q82129594
ChEMBL ID:CHEMBL1371049
Mol file:26131-64-6.mol

Synonyms:26131-64-6;5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol;5-(4-Chloro-phenyl)-4-ethyl-4H-[1,2,4]triazole-3-thiol;3-(4-chlorophenyl)-4-ethyl-1H-1,2,4-triazole-5-thione;5-(4-chlorophenyl)-4-ethyl-1,2,4-triazole-3-thiol;MLS000067634;5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl hydrosulfide;MFCD01164030;SMR000115863;5-(4-chlorophenyl)-4-ethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione;cid_726835;SCHEMBL1543969;SCHEMBL8978563;CHEMBL1371049;BDBM80122;DTXSID10352446;HMS2391K14;SMSF0008983;STK118179;STK877578;AKOS000100176;AKOS000348102;CB00862;LS-01250;BB 0217264;CS-0116547;EN300-03204;AG-690/12886821;Z56922041;5-(4-chlorophenyl)-4-ethyl-4H-[1,2,4]triazole-3-thiol

Suppliers and Price of 5-(4-chlorophenyl)-4-ethyl-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:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Matrix Scientific
5-(4-Chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
500mg
$ 95.00

Crysdot
5-(4-Chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol 97%
5g
$ 297.00

Biosynth Carbosynth
5-(4-Chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
5 g
$ 578.00

Biosynth Carbosynth
5-(4-Chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
1 g
$ 170.00

Biosynth Carbosynth
5-(4-Chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
500 mg
$ 100.00

Biosynth Carbosynth
5-(4-Chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
250 mg
$ 57.50

Biosynth Carbosynth
5-(4-Chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
2 g
$ 289.00

American Custom Chemicals Corporation
5-(4-CHLORO-PHENYL)-4-ETHYL-4H-[1,2,4]TRIAZOLE-3-THIOL 95.00%
5G
$ 1005.43

American Custom Chemicals Corporation
5-(4-CHLORO-PHENYL)-4-ETHYL-4H-[1,2,4]TRIAZOLE-3-THIOL 95.00%
2.5G
$ 852.21

American Custom Chemicals Corporation
5-(4-CHLORO-PHENYL)-4-ETHYL-4H-[1,2,4]TRIAZOLE-3-THIOL 95.00%
1G
$ 648.81

Total 6 raw suppliers

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

Chemical Property:

Vapor Pressure:0.000483mmHg at 25°C
Boiling Point:313.9°Cat760mmHg
Flash Point:143.6°C
PSA：69.51000
Density:1.37g/cm³
LogP:2.90710
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:239.0283962
Heavy Atom Count:15
Complexity:284

Purity/Quality:

98%min ^*data from raw suppliers

5-(4-Chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN1C(=NNC1=S)C2=CC=C(C=C2)Cl

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

There total 8 articles about 5-(4-chlorophenyl)-4-ethyl-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: 92.0%

: 26131-22-6
1-(4-chloro-benzoyl)-4-ethyl-thiosemicarbazide

: 26131-64-6
5-(4-chlorophenyl)-4-ethyl-1,2,4-triazole-3-thiol

Guidance literature:: With sodium hydroxide; for 4h; Heating;
DOI:10.1002/jhet.5570290512

Reference yield: 68.0%

: 26131-22-6
1-(4-chloro-benzoyl)-4-ethyl-thiosemicarbazide

: 26131-64-6
5-(4-Chloro-phenyl)-4-ethyl-2,4-dihydro-[1,2,4]triazole-3-thione

Guidance literature:: With sodium hydrogencarbonate; for 24h; Heating;

Reference yield:

: 122-01-0
4-chloro-benzoyl chloride

: 26131-64-6
5-(4-Chloro-phenyl)-4-ethyl-2,4-dihydro-[1,2,4]triazole-3-thione

Guidance literature:: Multi-step reaction with 2 steps

1: 52 percent / pyridine / 17 h / Ambient temperature

2: 68 percent / 1M aq. NaHCO₃ / 24 h / Heating

With pyridine; sodium hydrogencarbonate;