Ethyl 4-(3-oxocyclohexyl)butanoate

Base Information

Chemical Name:Ethyl 4-(3-oxocyclohexyl)butanoate
CAS No.:100315-21-7
Molecular Formula:C12H20O3
Molecular Weight:212.289
Hs Code.:
DSSTox Substance ID:DTXSID30552128
Nikkaji Number:J2.468.478D
Mol file:100315-21-7.mol

Synonyms:ethyl 4-(3-oxocyclohexyl)butanoate;100315-21-7;Cyclohexanebutanoic acid, 3-oxo-, ethyl ester;SCHEMBL8463385;DTXSID30552128;4-(3-oxo-cyclohexyl)-butyric acid ethyl ester

Suppliers and Price of Ethyl 4-(3-oxocyclohexyl)butanoate

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
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price

Total 0 raw suppliers

Chemical Property of Ethyl 4-(3-oxocyclohexyl)butanoate

Chemical Property:

Boiling Point:299.7±13.0 °C(Predicted)
PSA：43.37000
Density:1.010±0.06 g/cm3(Predicted)
LogP:2.47910
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:212.14124450
Heavy Atom Count:15
Complexity:223

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CCCC1CCCC(=O)C1

Technology Process of Ethyl 4-(3-oxocyclohexyl)butanoate

There total 10 articles about Ethyl 4-(3-oxocyclohexyl)butanoate 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: 64.0%

: 930-68-7
cyclohexenone

: 104089-17-0
ethyl 4-(iodozincio)butanoate

: 100315-21-7
ethyl 4-(3-oxocyclohexyl)butanoate

Guidance literature:: With chloro-trimethyl-silane; at 27 ℃; for 1.5h;

Reference yield: 56.0%

: 930-68-7
cyclohexenone

: 7425-53-8
ethyl 4-iodobutyrate

: 100315-21-7
ethyl 4-(3-oxocyclohexyl)butanoate

Guidance literature:: ethyl 4-iodobutyrate; With chloro-trimethyl-silane; ethylene dibromide; zinc; In tetrahydrofuran;

With copper diacetate; lithium chloride; In tetrahydrofuran;

cyclohexenone; With chloro-trimethyl-silane; In tetrahydrofuran; diethyl ether;
DOI:10.1055/s-2005-923581