Cyclohexanecarboxylic acid, 2,4,4-trimethyl-6-oxo-, methyl ester

Base Information

Chemical Name:Cyclohexanecarboxylic acid, 2,4,4-trimethyl-6-oxo-, methyl ester
CAS No.:54576-10-2
Molecular Formula:C11H18O3
Molecular Weight:198.2588
Hs Code.:
DSSTox Substance ID:DTXSID40886103
Nikkaji Number:J429.260J
Mol file:54576-10-2.mol

Synonyms:Carbomethoxydihydroisophorone;54576-10-2;Cyclohexanecarboxylic acid, 2,4,4-trimethyl-6-oxo-, methyl ester;DTXSID40886103;2,4,4-Trimethyl-6-oxocyclohexanecarboxylic acid methyl ester

Suppliers and Price of Cyclohexanecarboxylic acid, 2,4,4-trimethyl-6-oxo-, methyl ester

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 3 raw suppliers

Chemical Property of Cyclohexanecarboxylic acid, 2,4,4-trimethyl-6-oxo-, methyl ester

Chemical Property:

Vapor Pressure:0.0154mmHg at 25°C
Boiling Point:256.5°Cat760mmHg
Flash Point:105.5°C
Density:0.996g/cm³
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:198.125594432
Heavy Atom Count:14
Complexity:255

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CC(CC(=O)C1C(=O)OC)(C)C

Technology Process of Cyclohexanecarboxylic acid, 2,4,4-trimethyl-6-oxo-, methyl ester

There total 2 articles about Cyclohexanecarboxylic acid, 2,4,4-trimethyl-6-oxo-, methyl ester 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:

: 54576-04-4
2-Methoxycarbonyloxy-4,4,6-trimethyl-cyclohex-1-enecarboxylic acid methyl ester

: 54576-10-2
2-Carbomethoxy-3.5.5-trimethoxycyclohexanon

Guidance literature:: With methanol; sodium;
DOI:10.1021/jo00898a024

Reference yield:

: 4694-17-1
5,5-dimethlycyclohex-2-en-1-one

: 54576-10-2
2-Carbomethoxy-3.5.5-trimethoxycyclohexanon

Guidance literature:: Multi-step reaction with 2 steps

1: (i) CuI, (ii) /BRN= 1209504/, (iii) /BRN= 605437/

2: Na, MeOH

With methanol; sodium;
DOI:10.1021/jo00898a024