1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone

Base Information

Chemical Name:1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone
CAS No.:105533-69-5
Molecular Formula:C8H6ClFO2
Molecular Weight:188.586
Hs Code.:2914700090
DSSTox Substance ID:DTXSID70546723
Wikidata:Q82424629
Mol file:105533-69-5.mol

Synonyms:105533-69-5;1-(4-CHLORO-5-FLUORO-2-HYDROXY-PHENYL)-ETHANONE;1-(4-chloro-5-fluoro-2-hydroxyphenyl)ethanone;1-(4-CHLORO-5-FLUORO-2-HYDROXYPHENYL)ETHAN-1-ONE;SCHEMBL4158847;DTXSID70546723;NEWKAXPVJZLECS-UHFFFAOYSA-N;AKOS006330861;MB07188;CS-0133072;F95392

Suppliers and Price of 1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone

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

Matrix Scientific
1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone >97%
1g
$ 1826.00

Matrix Scientific
1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone >97%
500mg
$ 1351.00

Crysdot
1-(4-Chloro-5-fluoro-2-hydroxyphenyl)ethanone 97%
1g
$ 1268.00

Chemcia Scientific
1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone 95%
1 G
$ 395.00

American Custom Chemicals Corporation
1-(4-CHLORO-5-FLUORO-2-HYDROXY-PHENYL)-ETHANONE 95.00%
5MG
$ 497.45

Total 3 raw suppliers

Chemical Property of 1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone

Chemical Property:

Melting Point:72°C
PSA：37.30000
LogP:2.38730
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:188.0040353
Heavy Atom Count:12
Complexity:186

Purity/Quality:

99%+ ^*data from raw suppliers

1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone >97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C1=CC(=C(C=C1O)Cl)F

Technology Process of 1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone

There total 6 articles about 1-(4-Chloro-5-fluoro-2-hydroxy-phenyl)-ethanone 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: 90.0%

: 199586-28-2
1-Acetoxy-3-chloro-4-fluorobenzene

: 105533-69-5
4-Chloro-5-fluoro-2-hydroxyacetophenone

Guidance literature:: With aluminium trichloride; at 150 ℃; for 1h;
DOI:10.1016/S0014-827X(99)00047-6

Reference yield:

: 2613-23-2
3-chloro-4-fluorophenol

: 75-36-5
acetyl chloride

: 105533-69-5
4-Chloro-5-fluoro-2-hydroxyacetophenone

Guidance literature:: 3-chloro-4-fluorophenol; acetyl chloride; In toluene; at 40 ℃;

With aluminium trichloride; In toluene; at 80 ℃; Further stages.;
DOI:10.1021/jm061428x

Reference yield:

: 2613-23-2
3-chloro-4-fluorophenol

: 105533-69-5
4-Chloro-5-fluoro-2-hydroxyacetophenone

Guidance literature:: Multi-step reaction with 2 steps

1.1: triethylamine / CH₂Cl₂ / 15 h / 0 - 20 °C

2.1: aluminum trichloride / 20 - 70 °C

2.2: 1.5 h / 140 °C

With aluminium trichloride; triethylamine; In dichloromethane; 2.1: Fries rearrangement;
DOI:10.1021/jm060683e