Ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate

Base Information

Chemical Name:Ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate
CAS No.:359424-42-3
Molecular Formula:C11H10F2O3
Molecular Weight:228.195
Hs Code.:2918300090
DSSTox Substance ID:DTXSID50543553
Nikkaji Number:J3.327.280D
Wikidata:Q82420470
Mol file:359424-42-3.mol

Synonyms:Ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate;359424-42-3;Ethyl 3-(3,5-Difluorophenyl)-3-oxopropionate;ETHYL 3',5'-DIFLUOROBENZOYLACETATE;MFCD07783525;ethyl 3,5-difluorobenzoylacetate;AM935;ETHYL (3,5-DIFLUOROBENZOYL)ACETATE;SCHEMBL2459005;DTXSID50543553;SJQAWRHMPXRCRM-UHFFFAOYSA-N;AC5991;AKOS000265585;AS-61714;SY058438;CS-0099782;Ethyl3-(3,5-difluorophenyl)-3-oxopropanoate;ethyl 3-(3,5-difluorophenyl)-3-oxo-propanoate;A852388;ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate

Suppliers and Price of Ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate

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

SynChem
3-(3,5-Difluorophenyl)-3-oxo-propionic acid ethyl ester 95+%
1 g
$ 225.00

SynChem
3-(3,5-Difluorophenyl)-3-oxo-propionic acid ethyl ester 95+%
5 g
$ 675.00

Crysdot
Ethyl3-(3,5-difluorophenyl)-3-oxopropanoate 95+%
1g
$ 353.00

Chemenu
ethyl3-(3,5-difluorophenyl)-3-oxopropanoate 95%
1g
$ 333.00

American Custom Chemicals Corporation
ETHYL 3-(3,5-DIFLUOROPHENYL)-3-OXOPROPANOATE 95.00%
5G
$ 1606.90

American Custom Chemicals Corporation
ETHYL 3-(3,5-DIFLUOROPHENYL)-3-OXOPROPANOATE 95.00%
1G
$ 879.25

Ambeed
Ethyl3-(3,5-difluorophenyl)-3-oxopropanoate 95%
250mg
$ 73.00

Ambeed
Ethyl3-(3,5-difluorophenyl)-3-oxopropanoate 95%
100mg
$ 45.00

Ambeed
Ethyl3-(3,5-difluorophenyl)-3-oxopropanoate 95%
1g
$ 191.00

Ambeed
Ethyl3-(3,5-difluorophenyl)-3-oxopropanoate 95%
5g
$ 672.00

Total 14 raw suppliers

Chemical Property of Ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate

Chemical Property:

Boiling Point:275.8±25.0 °C(Predicted)
PKA:10.35±0.50(Predicted)
PSA：43.37000
Density:1.251±0.06 g/cm3(Predicted)
LogP:2.10070
Storage Temp.:Inert atmosphere,Room Temperature
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:228.05980050
Heavy Atom Count:16
Complexity:258

Purity/Quality:

97% ^*data from raw suppliers

3-(3,5-Difluorophenyl)-3-oxo-propionic acid ethyl ester 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CC(=O)C1=CC(=CC(=C1)F)F

Technology Process of Ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate

There total 3 articles about Ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate 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: 85.0%

: 359424-42-3
3-(3,5-difluorophenyl)-3-oxopropionic acid ethyl ester

Guidance literature:

Reference yield: 68.0%

: 15226-74-1,61091-28-9,61117-58-6
dicobalt octacarbonyl

: 461-96-1
3,5-difluorobromobenzene

: 6148-64-7
ethyl potassium malonate

: 359424-42-3
3-(3,5-difluorophenyl)-3-oxopropionic acid ethyl ester

Guidance literature:: With 1H-imidazole; palladium diacetate; triethylamine; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; magnesium chloride; In tetrahydrofuran; at 90 ℃; for 0.5h; Microwave irradiation;
DOI:10.1016/j.tetlet.2014.04.087

Reference yield:

: 129714-97-2
3,5-difluorobenzoyl chloride

: 141-78-6
ethyl acetate

: 359424-42-3
3-(3,5-difluorophenyl)-3-oxopropionic acid ethyl ester

Guidance literature:: ethyl acetate; With lithium diisopropyl amide; In tetrahydrofuran; at -78 ℃; for 0.5h;

3,5-difluorobenzoyl chloride; In tetrahydrofuran;
DOI:10.1021/acs.jmedchem.7b00941