2-Cyclohexen-1-one, 2,6,6-trimethyl-3-(2-methylpropoxy)-

Base Information

Chemical Name:2-Cyclohexen-1-one, 2,6,6-trimethyl-3-(2-methylpropoxy)-
CAS No.:60068-02-2
Molecular Formula:C13H22O2
Molecular Weight:210.316
Hs Code.:
DSSTox Substance ID:DTXSID70448430
Nikkaji Number:J1.392.490B
Wikidata:Q82267410

Synonyms:60068-02-2;2,6,6-trimethyl-3-isobutoxycyclohex-2-en-1-one;2-Cyclohexen-1-one, 2,6,6-trimethyl-3-(2-methylpropoxy)-;2,6,6-trimethyl-3-(2-methylpropoxy)cyclohex-2-en-1-one;SCHEMBL6228499;DTXSID70448430;SXLMFWKZJWAAIB-UHFFFAOYSA-N;AKOS032961411;2,6,6-Trimethyl-3-isobutoxy-2-cyclohexene-1-one;2,6,6-trimethyl-3-isobutoxycyclohex-2-en-1 one;3-isobutoxy-2,6,6-trimethyl-2-cyclohexen-1-one;3-isobutoxy-2,6,6-trimethyl-cyclohex-2-en-1-one

Suppliers and Price of 2-Cyclohexen-1-one, 2,6,6-trimethyl-3-(2-methylpropoxy)-

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
Packaging
price

Total 4 raw suppliers

Chemical Property of 2-Cyclohexen-1-one, 2,6,6-trimethyl-3-(2-methylpropoxy)-

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:210.161979940
Heavy Atom Count:15
Complexity:285

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=C(CCC(C1=O)(C)C)OCC(C)C

Technology Process of 2-Cyclohexen-1-one, 2,6,6-trimethyl-3-(2-methylpropoxy)-

There total 8 articles about 2-Cyclohexen-1-one, 2,6,6-trimethyl-3-(2-methylpropoxy)- 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:

: 2,6,6-trimethylcyclohexen-1,3-dione

: 60068-02-2
2,6,6-Trimethyl-3-isobutoxycyclohex-2-en-1-one

Guidance literature:: With PTSA; In 2-methyl-propan-1-ol; benzene;

Reference yield:

: 1629-58-9
4-penten-3-one

: 60068-02-2
2,6,6-Trimethyl-3-isobutoxycyclohex-2-en-1-one

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) LDA / 1.) THF, hexane, -60 deg C, 90 min, 2.) a) 3 min, b) RT, 2 h

2: 85 percent / NaH / methanol / 3 h / Heating

3: 91 percent / p-toluenesulfonic acid / benzene / 3 h / Heating

With sodium hydride; toluene-4-sulfonic acid; lithium diisopropyl amide; In methanol; benzene;
DOI:10.1021/jo00132a028

Reference yield:

: 64095-45-0
2,2-dimethyl-5-oxo-heptanoic acid methyl ester

: 60068-02-2
2,6,6-Trimethyl-3-isobutoxycyclohex-2-en-1-one

Guidance literature:: Multi-step reaction with 2 steps

1: 85 percent / NaH / methanol / 3 h / Heating

2: 91 percent / p-toluenesulfonic acid / benzene / 3 h / Heating

With sodium hydride; toluene-4-sulfonic acid; In methanol; benzene;
DOI:10.1021/jo00132a028