3-Isobutoxy-2,6-dimethyl-2-cyclohexen-1-one

Base Information

Chemical Name:3-Isobutoxy-2,6-dimethyl-2-cyclohexen-1-one
CAS No.:73723-49-6
Molecular Formula:C12H20O2
Molecular Weight:196.29
Hs Code.:
DSSTox Substance ID:DTXSID30474073

Synonyms:3-isobutoxy-2,6-dimethyl-2-cyclohexen-1-one;73723-49-6;2-Cyclohexen-1-one, 2,6-dimethyl-3-(2-methylpropoxy)-;DTXSID30474073

Suppliers and Price of 3-Isobutoxy-2,6-dimethyl-2-cyclohexen-1-one

Supply Marketing:

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

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Chemical Property of 3-Isobutoxy-2,6-dimethyl-2-cyclohexen-1-one

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:196.146329876
Heavy Atom Count:14
Complexity:251

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CCC(=C(C1=O)C)OCC(C)C

Technology Process of 3-Isobutoxy-2,6-dimethyl-2-cyclohexen-1-one

There total 3 articles about 3-Isobutoxy-2,6-dimethyl-2-cyclohexen-1-one 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: 80.0%

: 37457-15-1
3-isobutoxy-2-methyl-2-cyclohexen-1-one

: 74-88-4
methyl iodide

: 73723-49-6
3-isobutoxy-2,6-dimethylcyclohex-2-en-1-one

Guidance literature:: 3-isobutoxy-2-methyl-2-cyclohexen-1-one; With n-butyllithium; diisopropylamine; In tetrahydrofuran; hexanes; at -78 - 0 ℃; Inert atmosphere;

methyl iodide; In tetrahydrofuran; hexanes; for 4.5h; Inert atmosphere;
DOI:10.1021/ol802409h

Reference yield:

: 1193-55-1
2-methylcyclohexane-1,3-dione

: 73723-49-6
3-isobutoxy-2,6-dimethylcyclohex-2-en-1-one

Guidance literature:: Multi-step reaction with 2 steps

1: 93 percent / p-toluenesulfonic acid monohydrate / benzene / 36 h / Heating

2: 1.) LDA / 1.) hexane, THF, -78 deg C, 45 min, 2.) hexane, THF, from -78 deg C to RT, 12 h

With toluene-4-sulfonic acid; lithium diisopropyl amide; In benzene;