Ethyl (2,6-dimethylcyclohex-1-en-1-yl)acetate

Base Information

Chemical Name:Ethyl (2,6-dimethylcyclohex-1-en-1-yl)acetate
CAS No.:61346-66-5
Molecular Formula:C12H20O2
Molecular Weight:196.29
Hs Code.:
DSSTox Substance ID:DTXSID80506757

Synonyms:61346-66-5;DTXSID80506757;Ethyl (2,6-dimethylcyclohex-1-en-1-yl)acetate

Suppliers and Price of Ethyl (2,6-dimethylcyclohex-1-en-1-yl)acetate

Supply Marketing:

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

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Chemical Property of Ethyl (2,6-dimethylcyclohex-1-en-1-yl)acetate

Chemical Property:

XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:196.146329876
Heavy Atom Count:14
Complexity:241

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CC1=C(CCCC1C)C

Technology Process of Ethyl (2,6-dimethylcyclohex-1-en-1-yl)acetate

There total 2 articles about Ethyl (2,6-dimethylcyclohex-1-en-1-yl)acetate 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: 90.0%

: 64566-29-6
ethyl (1-hydroxy-2,6-dimethylcyclohexyl)acetate

: 61346-66-5
ethyl 2,6-dimethyl-1-cyclohexeneacetate

Guidance literature:: With pyridine; thionyl chloride; In diethyl ether; at 0 ℃; for 2h;
DOI:10.1021/ja00398a021

Reference yield:

: 2816-57-1
2,6-dimethylcyclohexanone

: 61346-66-5
ethyl 2,6-dimethyl-1-cyclohexeneacetate

Guidance literature:: Multi-step reaction with 2 steps

1: 92 percent / LDA / tetrahydrofuran / 1.) -78 deg C, 1 h, 2.) room temperature, 2 h

2: 90 percent / thionyl chloride, pyridine / diethyl ether / 2 h / 0 °C

With pyridine; thionyl chloride; lithium diisopropyl amide; In tetrahydrofuran; diethyl ether;
DOI:10.1021/ja00398a021