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

Base Information

Chemical Name:4-(4-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol
CAS No.:60870-39-5
Molecular Formula:C₁₂H₈ClN₃OS
Molecular Weight:277.734
Hs Code.:
DSSTox Substance ID:DTXSID30354245
Wikidata:Q82132278
ChEMBL ID:CHEMBL1539766

Synonyms:4-(4-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol;60870-39-5;4-(4-chlorophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5-thione;SBB040403;MLS000712248;CHEMBL1539766;DTXSID30354245;HMS2675N07;AKOS000268441;WAY-299174;SMR000282015;CS-0222189;EN300-110614;4-(4-chlorophenyl)-5-furan-2-yl-4H-[1,2,4]triazole-3-thiol;4-(4-Chlorophenyl)-3-(furan-2-yl)-1H-1,2,4-triazole-5(4H)-thione

Suppliers and Price of 4-(4-chlorophenyl)-5-(furan-2-yl)-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

AK Scientific
4-(4-Chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol
10g
$ 1337.00

AK Scientific
4-(4-Chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol
2.5g
$ 664.00

AK Scientific
4-(4-Chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol
500mg
$ 289.00

AK Scientific
4-(4-Chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol
100mg
$ 172.00

Total 1 raw suppliers

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

Chemical Property:

Melting Point:274-275 °C(Solv: ethanol (64-17-5))
Boiling Point:389.6±48.0 °C(Predicted)
PSA：82.65000
Density:1.50±0.1 g/cm3(Predicted)
LogP:3.46940
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:277.0076608
Heavy Atom Count:18
Complexity:368

Purity/Quality:

99% ^*data from raw suppliers

4-(4-Chlorophenyl)-5-(furan-2-yl)-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:C1=COC(=C1)C2=NNC(=S)N2C3=CC=C(C=C3)Cl

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

There total 4 articles about 4-(4-chlorophenyl)-5-(furan-2-yl)-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: 72.0%

: 60870-35-1
1-[(furan-2-carbonyl)]-4-[4-chlorophenyl]thiosemicarbazide

: 60870-39-5
4-(4-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol

Guidance literature:: With sodium hydroxide; for 4h; Heating;

Reference yield:

: 3326-71-4
2-furoic acid hydrazide

: 60870-39-5
4-(4-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / benzene / 6 h / Heating

2: 72 percent / aq. NaOH / 4 h / Heating

With sodium hydroxide; In benzene;

Reference yield:

: 2131-55-7
4-Chlorophenyl isothiocyanate

: 60870-39-5
4-(4-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / benzene / 6 h / Heating

2: 72 percent / aq. NaOH / 4 h / Heating

With sodium hydroxide; In benzene;