1-(4-Fluorophenyl)-2-mercaptoethanone

Base Information

Chemical Name:1-(4-Fluorophenyl)-2-mercaptoethanone
CAS No.:181931-42-0
Molecular Formula:C₈H₇FOS
Molecular Weight:170.207
Hs Code.:
DSSTox Substance ID:DTXSID20442362
Wikidata:Q82259598

Synonyms:1-(4-fluorophenyl)-2-mercaptoethanone;SCHEMBL4597910;DTXSID20442362;181931-42-0

Suppliers and Price of 1-(4-Fluorophenyl)-2-mercaptoethanone

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 1-(4-Fluorophenyl)-2-mercaptoethanone

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:170.02016418
Heavy Atom Count:11
Complexity:141

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(=O)CS)F

Technology Process of 1-(4-Fluorophenyl)-2-mercaptoethanone

There total 4 articles about 1-(4-Fluorophenyl)-2-mercaptoethanone 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: 52.0%

: 181931-41-9
S-acetyl-2-mercapto-4’-fluoroacetophenone

: 181931-42-0
mercapto-1-(4’-fluorophenyl)ethanone

Guidance literature:: With sodium hydroxide; In diethyl ether; water; at 20 ℃; for 20h;
DOI:10.1039/c7ob02397a

Reference yield:

: 403-29-2
2-bromo-4'-fluoroacetophenone

: 181931-42-0
mercapto-1-(4’-fluorophenyl)ethanone

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium carbonate / ethanol / 0.33 h / 20 °C

1.2: 3 h / 20 °C

2.1: sodium hydroxide / diethyl ether; water / 20 h / 20 °C

With potassium carbonate; sodium hydroxide; In diethyl ether; ethanol; water;
DOI:10.1039/c7ob02397a

Reference yield:

: 403-42-9
1-(4-fluorophenyl)ethanone

: 181931-42-0
mercapto-1-(4’-fluorophenyl)ethanone

Guidance literature:: Multi-step reaction with 3 steps

1: sodium hydrogencarbonate; bromine / dichloromethane / Inert atmosphere

2: acetone / 20 °C

3: hydrazine hydrate / acetonitrile; water / Cooling with ice

With bromine; sodium hydrogencarbonate; hydrazine hydrate; In dichloromethane; water; acetone; acetonitrile;
DOI:10.1021/acs.orglett.9b03018