2,3,6-Trimethylacetophenone

Base Information

Chemical Name:2,3,6-Trimethylacetophenone
CAS No.:54200-67-8
Molecular Formula:C11H14O
Molecular Weight:162.23
Hs Code.:2914399090
DSSTox Substance ID:DTXSID10541838
Nikkaji Number:J308.237G
Wikidata:Q82418289
Mol file:54200-67-8.mol

Synonyms:2,3,6-Trimethylacetophenone;54200-67-8;1-(2,3,6-trimethylphenyl)ethanone;2',3',6'-TRIMETHYLACETOPHENONE;SCHEMBL3742961;DTXSID10541838;FTKUYCGSPCDDGD-UHFFFAOYSA-N;AKOS006230092;1-(2,3,6-trimethylphenyl)ethan-1-one;A830031

Suppliers and Price of 2,3,6-Trimethylacetophenone

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

American Custom Chemicals Corporation
2,3,6-TRIMETHYLACETOPHENONE 95.00%
5MG
$ 503.28

AHH
2,3,6-Trimethylacetophenone 95%
25g
$ 335.00

Total 3 raw suppliers

Chemical Property of 2,3,6-Trimethylacetophenone

Chemical Property:

Vapor Pressure:0.0499mmHg at 25°C
Refractive Index:1.509
Boiling Point:235.5°C at 760 mmHg
Flash Point:101.4°C
PSA：17.07000
Density:0.955g/cm³
LogP:2.81440
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:162.104465066
Heavy Atom Count:12
Complexity:174

Purity/Quality:

98%min ^*data from raw suppliers

2,3,6-TRIMETHYLACETOPHENONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Safety Statements: S24/25:Avoid contact with skin and eyes.;

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2,3,6-Trimethylacetophenone

There total 5 articles about 2,3,6-Trimethylacetophenone 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: 25.0%

: 102676-97-1
1-(2,6,6-trimethyl-1,3-cyclohexadienyl)ethanol

: 41436-46-8
2,6,6-trimethyl-cyclohexa-1,3-dien-1-yl methyl ketone

: 54200-67-8
2',3',6'-trimethylacetophenone

: 3-acetyl-2,4,4-trimethyl-2,5-cyclohexadien-1-one

Guidance literature:: With manganese(IV) oxide; In dichloromethane; at 40 ℃;
DOI:10.1002/hlca.19850680517

Reference yield:

: 116-26-7
safranal

: 54200-67-8
2',3',6'-trimethylacetophenone

Guidance literature:: Multi-step reaction with 2 steps

1: 96 percent / diethyl ether / 1 h / Ambient temperature

2: 16 percent / MnO₂ / CH₂Cl₂ / 40 °C

With manganese(IV) oxide; In diethyl ether; dichloromethane;
DOI:10.1002/hlca.19850680517