4-(4-Fluorophenyl)thiophenol

Base Information

Chemical Name:4-(4-Fluorophenyl)thiophenol
CAS No.:200958-13-0
Molecular Formula:C₁₂H₉FS
Molecular Weight:204.268
Hs Code.:
DSSTox Substance ID:DTXSID20374659
Nikkaji Number:J928.623C
Wikidata:Q82163257
Mol file:200958-13-0.mol

Synonyms:4-(4-Fluorophenyl)thiophenol;200958-13-0;4-(4-fluorophenyl)benzenethiol;4'-Fluorobiphenyl-4-thiol;4'-FLUORO-[1,1'-BIPHENYL]-4-THIOL;SCHEMBL7002149;DTXSID20374659;HKHDKANLOZASGR-UHFFFAOYSA-N;FS-6273;CS-0336556

Suppliers and Price of 4-(4-Fluorophenyl)thiophenol

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

Rieke Metals
4-(4-FLUOROPHENYL)THIOPHENOL
5g
$ 1943.00

Rieke Metals
4-(4-FLUOROPHENYL)THIOPHENOL
1g
$ 809.00

Crysdot
4-(4-Fluorophenyl)thiophenol 95+%
1g
$ 517.00

Crysdot
4-(4-Fluorophenyl)thiophenol 95+%
5g
$ 1222.00

Crysdot
4-(4-Fluorophenyl)thiophenol 95+%
10g
$ 2199.00

American Custom Chemicals Corporation
4-(4-FLUOROPHENYL)THIOPHENOL 96.00%
1G
$ 1299.38

Alichem
4'-Fluorobiphenyl-4-thiol
1g
$ 1579.40

Alichem
4'-Fluorobiphenyl-4-thiol
500mg
$ 863.90

Alichem
4'-Fluorobiphenyl-4-thiol
250mg
$ 480.00

Total 3 raw suppliers

Chemical Property of 4-(4-Fluorophenyl)thiophenol

Chemical Property:

XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:204.04089962
Heavy Atom Count:14
Complexity:167

Purity/Quality:

99% ^*data from raw suppliers

4-(4-FLUOROPHENYL)THIOPHENOL ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 36/37/38
Safety Statements: 26-36/37/39

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=CC=C(C=C2)S)F

Technology Process of 4-(4-Fluorophenyl)thiophenol

There total 5 articles about 4-(4-Fluorophenyl)thiophenol 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: 75.0%

: 352-34-1
4-fluoro-1-iodobenzene

: 108-98-5
thiophenol

: 200958-13-0
4-(fluorophenyl)phenylsulfane

Guidance literature:: With C₂₄H₂₂N₆Ni; sodium t-butanolate; In N,N-dimethyl-formamide; acetonitrile; at 20 ℃; for 24h; Inert atmosphere; Schlenk technique;
DOI:10.1021/acs.joc.9b00075

Reference yield:

: 589-87-7
1,4-bromoiodobenzene

: 881664-15-9
4-[2-(biphenyl-4-ylsulfanyl)ethyl]pyridine

: 200958-13-0
4-(fluorophenyl)phenylsulfane

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / Pd₂(dba)3; Xantphos; i-Pr₂NEt / toluene / 15 h / Heating

2: 84 percent / Pd₂(dba)3; t-BuONa; D-t-BPF / toluene / 6 h / Heating

With tris(dibenzylideneacetone)dipalladium ⁽⁰⁾; D-t-BPF; N-ethyl-N,N-diisopropylamine; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; sodium t-butanolate; In toluene; 2: Buchwald-Hartwig reaction;
DOI:10.1021/jo052624z