Ethyl alpha-acetyl-2-bromobenzenepropanoate

Base Information

Chemical Name:Ethyl alpha-acetyl-2-bromobenzenepropanoate
CAS No.:107408-19-5
Molecular Formula:C₁₃H₁₅BrO₃
Molecular Weight:299.164
Hs Code.:
DSSTox Substance ID:DTXSID301279346
Nikkaji Number:J2.949.796F

Synonyms:SCHEMBL6988601;DTXSID301279346;107408-19-5;Ethyl alpha-acetyl-2-bromobenzenepropanoate

Suppliers and Price of Ethyl alpha-acetyl-2-bromobenzenepropanoate

Supply Marketing:

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

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Chemical Property of Ethyl alpha-acetyl-2-bromobenzenepropanoate

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:298.02046
Heavy Atom Count:17
Complexity:278

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C(CC1=CC=CC=C1Br)C(=O)C

Technology Process of Ethyl alpha-acetyl-2-bromobenzenepropanoate

There total 3 articles about Ethyl alpha-acetyl-2-bromobenzenepropanoate 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: 86.0%

: 141-97-9
ethyl acetoacetate

: 3433-80-5
1-Bromo-2-bromomethyl-benzene

: 107408-19-5
ethyl 2-acetyl-3-(2-bromophenyl)propionate

Guidance literature:: With sodium ethanolate; In ethanol; for 15h; Heating;
DOI:10.1021/ja00216a033

Reference yield: 73.0%

: 20444-11-5
2-bromo-1-(4-methylbenzenesulfonyloxymethyl)benzene

: 141-97-9
ethyl acetoacetate

: 107408-19-5
ethyl 2-acetyl-3-(2-bromophenyl)propionate

Guidance literature:: ethyl acetoacetate; With sodium hydride; In tetrahydrofuran; at 0 ℃; for 0.25h; Inert atmosphere;

2-bromo-1-(4-methylbenzenesulfonyloxymethyl)benzene; In tetrahydrofuran; at 20 ℃; for 12h; Inert atmosphere;
DOI:10.1016/j.tet.2014.06.071

Reference yield:

: 18982-54-2
o-bromobenzyl alcohol

: 107408-19-5
ethyl 2-acetyl-3-(2-bromophenyl)propionate

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium hydroxide / diethyl ether / 3 h / 0 - 20 °C

2.1: sodium hydride / tetrahydrofuran / 0.25 h / 0 °C / Inert atmosphere

2.2: 12 h / 20 °C / Inert atmosphere

With sodium hydride; potassium hydroxide; In tetrahydrofuran; diethyl ether;
DOI:10.1016/j.tet.2014.06.071