Acetoacetic acid, 4-fluoro-, ethyl ester

Base Information

Chemical Name:Acetoacetic acid, 4-fluoro-, ethyl ester
CAS No.:372-37-2
Molecular Formula:C6H9 F O3
Molecular Weight:148.134
Hs Code.:2918300090
NSC Number:523377
UNII:Y36C4L3UZ4
DSSTox Substance ID:DTXSID30190685
Nikkaji Number:J55.352B
Wikidata:Q83063066
Mol file:372-37-2.mol

Synonyms:ethyl 4-fluoro-3-oxobutanoate;372-37-2;Ethyl 4-fluoroacetoacetate;ACETOACETIC ACID, 4-FLUORO-, ETHYL ESTER;Ethyl omega-fluoroacetoacetate;Butanoic acid, 4-fluoro-3-oxo-, ethyl ester;ETHYLG-FLUOROACETOACETATE;NSC 523377;BRN 1761273;Y36C4L3UZ4;NSC-523377;C6H9FO3;4-03-00-01546 (Beilstein Handbook Reference);ethyl fluoroacetoacetate;UNII-Y36C4L3UZ4;WLN: F1V1VO2;Ethyl 4-(fluoroaceto)acetate;ethyl4-fluoro-3-oxobutanoate;SCHEMBL1568475;ethyl 4-fluoro-3-oxo-butanoate;DTXSID30190685;Ethyl .omega.-(fluoroaceto)acetate;4-Fluoroacetoacetic acid ethyl ester;MFCD01672894;NSC523377;AKOS006279276;A858173

Suppliers and Price of Acetoacetic acid, 4-fluoro-, ethyl ester

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

American Custom Chemicals Corporation
ETHYL 4-FLUORO-3-OXOBUTANOATE 95.00%
5MG
$ 499.31

Total 14 raw suppliers

Chemical Property of Acetoacetic acid, 4-fluoro-, ethyl ester

Chemical Property:

Boiling Point:178.5°Cat760mmHg
PKA:9.52±0.46(Predicted)
Flash Point:60.5°C
PSA：43.37000
Density:1.108g/cm³
LogP:0.47820
XLogP3:0.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:148.05357231
Heavy Atom Count:10
Complexity:133

Purity/Quality:

97% ^*data from raw suppliers

ETHYL 4-FLUORO-3-OXOBUTANOATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CC(=O)CF

Technology Process of Acetoacetic acid, 4-fluoro-, ethyl ester

There total 6 articles about Acetoacetic acid, 4-fluoro-, ethyl ester 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: 100.0%

: 459-72-3
ethyl 2-fluoroacetate

: 141-78-6
ethyl acetate

: 372-37-2
ethyl 4-fluoro-3-oxo-butanoate

Guidance literature:: ethyl acetate; With lithium diisopropyl amide; In tetrahydrofuran; at -78 ℃; for 1h; Inert atmosphere;

ethyl 2-fluoroacetate; In tetrahydrofuran; at -78 - 20 ℃; Inert atmosphere;

Reference yield:

: 459-72-3
ethyl 2-fluoroacetate

: 107-92-6
butyric acid

: 372-37-2
ethyl 4-fluoro-3-oxo-butanoate

Guidance literature:: butyric acid; With lithium diisopropyl amide; In tetrahydrofuran; diethyl ether; n-heptane; ethylbenzene; at -78 ℃; for 0.5h; Inert atmosphere;

ethyl 2-fluoroacetate; In tetrahydrofuran; diethyl ether; n-heptane; ethylbenzene; at 25 ℃;