2,6,6-Trimethylcyclohexenemethyl acetate

Base Information

Chemical Name:2,6,6-Trimethylcyclohexenemethyl acetate
CAS No.:68406-89-3
Molecular Formula:C12H20O2
Molecular Weight:196.29
Hs Code.:
European Community (EC) Number:270-056-0,301-386-6
DSSTox Substance ID:DTXSID60240223
Nikkaji Number:J332.512A
Wikidata:Q83122968

Synonyms:.alpha.-Cyclogeraniol, acetate;2,6,6-Trimethylcyclohexenemethyl acetate;EINECS 301-386-6;68406-89-3;EINECS 270-056-0;94020-91-4;AI3-37229;2,6,6-Trimethylcyclohex-1-ene-1-methyl acetate;DTXSID60240223;1-Cyclohexene-1-methanol, 2,6,6-trimethyl-, acetate;Acetic acid (2,6,6-trimethyl-1-cyclohexen-1-yl)methyl ester

Suppliers and Price of 2,6,6-Trimethylcyclohexenemethyl acetate

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 2 raw suppliers

Chemical Property of 2,6,6-Trimethylcyclohexenemethyl acetate

Chemical Property:

Vapor Pressure:0.0347mmHg at 25°C
Boiling Point:242°Cat760mmHg
Flash Point:84.5°C
Density:0.927g/cm³
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:196.146329876
Heavy Atom Count:14
Complexity:262

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(CCC1)(C)C)COC(=O)C

Technology Process of 2,6,6-Trimethylcyclohexenemethyl acetate

There total 3 articles about 2,6,6-Trimethylcyclohexenemethyl 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:

: 472-20-8
β-cyclogeraniol

: 108-24-7
acetic anhydride

: 68406-89-3
α-cyclogeraniol acetate

Guidance literature:: With dmap; In pyridine; for 72h; Yield given; Ambient temperature;
DOI:10.1248/cpb.36.4711

Reference yield:

: 79-77-6,14901-07-6
(E)-β-ionone

: 68406-89-3
α-cyclogeraniol acetate

Guidance literature:: Multi-step reaction with 2 steps

1: 21.81 g / 1.) ozone; 2.) NaBH₄ / methanol / 4 h

2: 4-dimethylaminopyridine / pyridine / 72 h / Ambient temperature

With dmap; sodium tetrahydroborate; ozone; In pyridine; methanol;
DOI:10.1248/cpb.36.4711