3-OXO-4-PHENYL-BUTYRIC ACID ETHYL ESTER

Base Information

Chemical Name:3-OXO-4-PHENYL-BUTYRIC ACID ETHYL ESTER
CAS No.:718-08-1
Molecular Formula:C12H14O3
Molecular Weight:206.241
Hs Code.:2918300090
Mol file:718-08-1.mol

Synonyms:4-Phenylacetoacetic acid ethylester;Ethyl 3-keto-4-phenylbutyrate;Ethyl3-oxo-4-phenylbutyrate;Ethyl 3-oxo-4-phenylbutanoate;Acetoaceticacid, 4-phenyl-, ethyl ester (7CI,8CI);3-Oxo-4-phenylbutanoic acid ethylester;4-Phenyl-3-oxobutanoic acid ethyl ester;Ethyl4-phenyl-3-oxobutanoate;Ethyl 3-oxobenzenebutanoate;Ethyl 4-phenylacetoacetate;Ethyl b-oxobenzenebutanoate;NSC 15691;

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Chemical Property of 3-OXO-4-PHENYL-BUTYRIC ACID ETHYL ESTER

Chemical Property:

Vapor Pressure:0.00209mmHg at 25°C
Refractive Index:1.054-1.059
Boiling Point:290.3 °C at 760 mmHg
PKA:10.49±0.46(Predicted)
Flash Point:123.9 °C
PSA：43.37000
Density:1.091 g/cm³
LogP:1.75140
Storage Temp.:Inert atmosphere,Room Temperature
Solubility.:Chloroform (Slightly), DMSO (Slightly), Methanol (Sparingly)

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 36/37/38
Safety Statements: 26-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Uses Ethyl 3-oxo-4-phenylbutanoate is a useful synthetic intermediate. It is used to prepare pyrazolone derivatives as antiprion compounds. It is also used to prepare pyrrolinylaminopyrimidine analogs as inhibitors of AP-1 and NF-κB mediated gene expression.

Technology Process of 3-OXO-4-PHENYL-BUTYRIC ACID ETHYL ESTER

There total 50 articles about 3-OXO-4-PHENYL-BUTYRIC ACID 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%

: 1071-46-1
hydrogen ethyl malonate

: 103-80-0
phenylacetyl chloride

: 718-08-1
ethyl 3-oxo-4-phenylbutyrate

Guidance literature:: hydrogen ethyl malonate; With n-butyllithium; In tetrahydrofuran; hexane; at -78 - -10 ℃;

phenylacetyl chloride; In tetrahydrofuran; hexane; at -78 ℃; for 0.166667h; Further stages.;
DOI:10.1016/j.bmc.2008.05.049