Ethyl alpha-(1-cyclohexen-3-yl)acetoacetate

Base Information

Chemical Name:Ethyl alpha-(1-cyclohexen-3-yl)acetoacetate
CAS No.:107153-54-8
Molecular Formula:C₁₂H₁₈O₃
Molecular Weight:210.273
Hs Code.:
DSSTox Substance ID:DTXSID701283977
Nikkaji Number:J1.049.826K

Synonyms:107153-54-8;SCHEMBL6312583;QQVVMTHNQCAXTG-UHFFFAOYSA-N;DTXSID701283977;Ethyl alpha-acetyl-2-cyclohexene-1-acetate;Ethyl alpha-(1-cyclohexen-3-yl)acetoacetate;2-(2-Cyclohexenyl)-3-oxobutyric acid ethyl ester

Suppliers and Price of Ethyl alpha-(1-cyclohexen-3-yl)acetoacetate

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-(1-cyclohexen-3-yl)acetoacetate

Chemical Property:

XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:210.125594432
Heavy Atom Count:15
Complexity:268

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C(C1CCCC=C1)C(=O)C

Technology Process of Ethyl alpha-(1-cyclohexen-3-yl)acetoacetate

There total 6 articles about Ethyl alpha-(1-cyclohexen-3-yl)acetoacetate 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%

: 107153-54-8
2-(2-cyclohexen-1-yl)acetoacetic acid ethyl ester

Guidance literature:

Reference yield: 73.0%

: 141-97-9
ethyl acetoacetate

: 822-67-3
Cyclohex-2-enol

: 107153-54-8
2-(2-cyclohexen-1-yl)acetoacetic acid ethyl ester

Guidance literature:: With pyrrolidine; dichloro( 1,5-cyclooctadiene)platinum(ll); acetic acid; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In N,N-dimethyl-formamide; at 60 ℃; for 5h; regioselective reaction; Inert atmosphere; Schlenk technique; Microwave irradiation;
DOI:10.1002/anie.201311200

Reference yield: 40.0%

: 141-97-9
ethyl acetoacetate

: 1165952-91-9
cyclohexa-1,3-diene

: 107153-54-8
2-(2-cyclohexen-1-yl)acetoacetic acid ethyl ester

Guidance literature:: ethyl acetoacetate; With iron (III) chloride hexahydrate; In 1,4-dioxane; for 4h;

cyclohexa-1,3-diene; In 1,4-dioxane; at 80 ℃; for 8h;
DOI:10.1016/j.jorganchem.2010.09.031