Ethyl 2-(4-chlorophenyl)-3-oxobutanoate

Base Information

Chemical Name:Ethyl 2-(4-chlorophenyl)-3-oxobutanoate
CAS No.:30186-24-4
Molecular Formula:C₁₂H₁₃ClO₃
Molecular Weight:240.686
Hs Code.:
DSSTox Substance ID:DTXSID201288160
Nikkaji Number:J3.406.131I

Synonyms:30186-24-4;SCHEMBL17466104;DTXSID201288160;Ethyl alpha-acetyl-4-chlorobenzeneacetate

Suppliers and Price of Ethyl 2-(4-chlorophenyl)-3-oxobutanoate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Ethyl 2-(4-chlorophenyl)-3-oxobutanoate

Chemical Property:

XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:240.0553220
Heavy Atom Count:16
Complexity:257

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C(C1=CC=C(C=C1)Cl)C(=O)C

Technology Process of Ethyl 2-(4-chlorophenyl)-3-oxobutanoate

There total 7 articles about Ethyl 2-(4-chlorophenyl)-3-oxobutanoate 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: 75.0%

: C₆H₄ClCH(COCH₃)COOC₂H₅FeC₅H₅⁽¹⁺⁾*PF₆^(1-)

: 30186-24-4
ethyl 2-(4-chlorophenyl)-3-oxobutanoate

Guidance literature:: Sample heated for 1.0 h at 200-220°C and 1 torr.; Detection by spectral data.;
DOI:10.1016/0022-328X(88)80343-7

Reference yield: 70.0%

: 141-97-9
ethyl acetoacetate

: bis(4-chlorophenyl)iodonium tetrafluoroborate

: 30186-24-4
ethyl 2-(4-chlorophenyl)-3-oxobutanoate

Guidance literature:: ethyl acetoacetate; With potassium tert-butylate; In N,N-dimethyl-formamide; at 0 ℃; for 0.5h; Inert atmosphere;

bis(4-chlorophenyl)iodonium tetrafluoroborate; In N,N-dimethyl-formamide; at 0 - 20 ℃; Inert atmosphere;
DOI:10.1021/jo5023958

Reference yield: 33.3%

: 14062-24-9
4-chloro-benzeneacetic acid, ethyl ester

: 75-36-5
acetyl chloride

: 30186-24-4
ethyl 2-(4-chlorophenyl)-3-oxobutanoate

Guidance literature:: 4-chloro-benzeneacetic acid, ethyl ester; With lithium hexamethyldisilazane; In tetrahydrofuran; at -78 ℃; for 0.166667h; Inert atmosphere;

acetyl chloride; In tetrahydrofuran; at 0 ℃; for 1h; Inert atmosphere;