Phenol, 4-[[4-(trifluoromethyl)phenyl]thio]-

Base Information

Chemical Name:Phenol, 4-[[4-(trifluoromethyl)phenyl]thio]-
CAS No.:53451-92-6
Molecular Formula:C13H9F3OS
Molecular Weight:270.275
Hs Code.:
DSSTox Substance ID:DTXSID30459183
Nikkaji Number:J2.190.297G
Wikidata:Q82282862
Mol file:53451-92-6.mol

Synonyms:Phenol, 4-[[4-(trifluoromethyl)phenyl]thio]-;53451-92-6;SCHEMBL6251649;DTXSID30459183;BQFRILLRXFDYAH-UHFFFAOYSA-N;AKOS006113663;4-[4-(Trifluoromethyl)phenylthio]phenol;4-([4-(TRIFLUOROMETHYL)PHENYL]SULFANYL)PHENOL

Suppliers and Price of Phenol, 4-[[4-(trifluoromethyl)phenyl]thio]-

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 1 raw suppliers

Chemical Property of Phenol, 4-[[4-(trifluoromethyl)phenyl]thio]-

Chemical Property:

XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:270.03262057
Heavy Atom Count:18
Complexity:254

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C(F)(F)F)SC2=CC=C(C=C2)O

Technology Process of Phenol, 4-[[4-(trifluoromethyl)phenyl]thio]-

There total 4 articles about Phenol, 4-[[4-(trifluoromethyl)phenyl]thio]- 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%

: 696-63-9
4-Methoxybenzenethiol

: 402-43-7
p-trifluoromethylphenyl bromide

: 53451-92-6
4-{[4-(trifluoromethyl)phenyl]thio}phenol

Guidance literature:: With sodium hydroxide; In N,N-dimethyl-formamide; at 120 ℃;

Reference yield:

: 540-38-5
p-Iodophenol

: 825-83-2
4-trifluoromethylbenzenethiol

: 53451-92-6
4-{[4-(trifluoromethyl)phenyl]thio}phenol

Guidance literature:: p-Iodophenol; With SPPSLHMP SynPhase Lanterns(R); 1,8-diazabicyclo[5.4.0]undec-7-ene; trichloroacetonitrile; boron trifluoride diethyl etherate; In tetrahydrofuran; at 20 ℃; for 1h;

4-trifluoromethylbenzenethiol; With borohydride polymer supported Amberlite(R) IRA₄₀₀; bis(bipyridine)nickel(II) bromide; In tetrahydrofuran; ethanol; at 70 ℃; for 15h;

With trifluoroacetic acid; In dichloromethane;
DOI:10.1021/ol050939v

Reference yield:

: 696-63-9
4-Methoxybenzenethiol

: 53451-92-6
4-{[4-(trifluoromethyl)phenyl]thio}phenol

Guidance literature:: Multi-step reaction with 2 steps

1: NaOH / dimethylformamide / Heating

2: aq. HBr / acetic acid / Heating

With sodium hydroxide; hydrogen bromide; In acetic acid; N,N-dimethyl-formamide;