2-Hydroxy-4,4,6-trimethyl-6-(prop-2-en-1-yl)cyclohex-2-en-1-one

Base Information

Chemical Name:2-Hydroxy-4,4,6-trimethyl-6-(prop-2-en-1-yl)cyclohex-2-en-1-one
CAS No.:104994-71-0
Molecular Formula:C₁₂H₁₈O₂
Molecular Weight:194.274
Hs Code.:
DSSTox Substance ID:DTXSID80522977
Mol file:104994-71-0.mol

Synonyms:104994-71-0;DTXSID80522977;2-Hydroxy-4,4,6-trimethyl-6-(prop-2-en-1-yl)cyclohex-2-en-1-one

Suppliers and Price of 2-Hydroxy-4,4,6-trimethyl-6-(prop-2-en-1-yl)cyclohex-2-en-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 2-Hydroxy-4,4,6-trimethyl-6-(prop-2-en-1-yl)cyclohex-2-en-1-one

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:194.130679813
Heavy Atom Count:14
Complexity:299

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CC(C(=O)C(=C1)O)(C)CC=C)C

Technology Process of 2-Hydroxy-4,4,6-trimethyl-6-(prop-2-en-1-yl)cyclohex-2-en-1-one

There total 1 articles about 2-Hydroxy-4,4,6-trimethyl-6-(prop-2-en-1-yl)cyclohex-2-en-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:

: 77426-40-5
2-Allyloxy-3,5,5-trimethyl-cyclohex-2-enone

: 104994-71-0
6-Allyl-2-hydroxy-4,4,6-trimethyl-cyclohex-2-enone

: 77432-02-1
3-allyl-3,5,5-trimethyl-1,2-cyclohexanedione

Guidance literature:: In chlorobenzene; at 132 ℃; Product distribution; half-lives for rearrangement;
DOI:10.1021/jo00169a071

Reference yield:

: 104994-71-0
6-Allyl-2-hydroxy-4,4,6-trimethyl-cyclohex-2-enone

: 104994-74-3
6-Allyl-2-chloro-4,4,6-trimethyl-cyclohex-2-enone

Guidance literature:: Multi-step reaction with 2 steps

1: 1 M aq. LiOH / CHCl₃ / Ambient temperature

2: 85 percent / LiCl, acetic acid / acetonitrile / 80 °C

With lithium hydroxide; acetic acid; lithium chloride; In chloroform; acetonitrile;
DOI:10.1021/jo00374a053