1-(4-fluorophenyl)-1H-tetrazole-5-thiol

Base Information

Chemical Name:1-(4-fluorophenyl)-1H-tetrazole-5-thiol
CAS No.:1544-79-2
Molecular Formula:C7H5FN4S
Molecular Weight:196.208
Hs Code.:
DSSTox Substance ID:DTXSID30355570
Wikidata:Q82134553
Mol file:1544-79-2.mol

Synonyms:1544-79-2;1-(4-fluorophenyl)-1H-tetrazole-5-thiol;1-(4-fluorophenyl)-2H-tetrazole-5-thione;1-(4-fluorophenyl)-1H-1,2,3,4-tetrazole-5-thiol;SCHEMBL8048128;DTXSID30355570;MFCD00101081;AKOS000669637;LS-04537;CS-0337082;AN-465/13570097;1-(4-fluorophenyl)-1H-tetraazol-5-yl hydrosulfide;1-(4-fluorophenyl)-1,4-dihydro-5h-tetrazole-5-thione

Suppliers and Price of 1-(4-fluorophenyl)-1H-tetrazole-5-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

Total 9 raw suppliers

Chemical Property of 1-(4-fluorophenyl)-1H-tetrazole-5-thiol

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:196.02189551
Heavy Atom Count:13
Complexity:237

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1N2C(=S)N=NN2)F

Technology Process of 1-(4-fluorophenyl)-1H-tetrazole-5-thiol

There total 5 articles about 1-(4-fluorophenyl)-1H-tetrazole-5-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: 63.23%

: 1544-68-9
4-fluorophenyl isothiocyanate

: 1544-79-2
1-(4-fluorophenyl)-1,4-dihydro-1H-tetrazole-5-thione

Guidance literature:: With sodium azide; In water; at 20 ℃; for 2h; Reflux;
DOI:10.1134/S0022476618070193

Reference yield:

: N-(4-fluorophenyl)dithiocarbamate triethylamine salt

: 1544-79-2
1-(4-fluorophenyl)tetrazole-5-thiol

Guidance literature:: Multi-step reaction with 2 steps

1: Et₃N; EtOCOCl / CHCl₃ / -10 - 20 °C

2: aq. NaN₃ / 3 h / Heating

With sodium azide; chloroformic acid ethyl ester; triethylamine; In chloroform;
DOI:10.1023/A:1015387108748

Reference yield:

: 371-40-4
4-fluoroaniline

: 1544-79-2
1-(4-fluorophenyl)tetrazole-5-thiol

Guidance literature:: Multi-step reaction with 3 steps

1: diethyl ether / 2 - 5 °C

2: Et₃N; EtOCOCl / CHCl₃ / -10 - 20 °C

3: aq. NaN₃ / 3 h / Heating

With sodium azide; chloroformic acid ethyl ester; triethylamine; In diethyl ether; chloroform;
DOI:10.1023/A:1015387108748