Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate

Base Information

Chemical Name:Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate
CAS No.:101327-97-3
Molecular Formula:C10H16O3
Molecular Weight:184.235
Hs Code.:
European Community (EC) Number:868-416-2
Nikkaji Number:J1.980.629D
Mol file:101327-97-3.mol

Synonyms:101327-97-3;methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate;methyl 3,3-dimethyl-2-oxocyclohexane-1-carboxylate;Cyclohexanecarboxylic acid, 3,3-dimethyl-2-oxo-, methyl ester;SCHEMBL3236730;AKOS018395307;EN300-1126792;2-Oxo-3,3-dimethylcyclohexanecarboxylic acid methyl ester

Suppliers and Price of Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate

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
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price

Total 1 raw suppliers

Chemical Property of Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:184.109944368
Heavy Atom Count:13
Complexity:230

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate

There total 2 articles about Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate 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: 78.0%

: 1193-47-1
2,2-dimethyl-cyclohexanone

: 616-38-6
carbonic acid dimethyl ester

: 101327-97-3
Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate

Guidance literature:: With sodium hydride; In benzene; for 22h; Heating;
DOI:10.1021/jo00102a015

Reference yield:

: 583-60-8
2-Methylcyclohexanone

: 101327-97-3
Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: NaH

2: NaH

With sodium hydride;
DOI:10.1016/S0040-4039(00)89191-1

Reference yield: 93.0%

: 101327-97-3
Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate

: 939-26-4
2-bromomethylnaphthyl bromide

: C₂₁H₂₄O₃

Guidance literature:: Methyl 3,3-dimethyl-2-oxocyclohexanecarboxylate; With sodium hydride; In tetrahydrofuran; N,N-dimethyl-formamide; at 20 ℃; for 0.25h;

2-bromomethylnaphthyl bromide; In tetrahydrofuran; N,N-dimethyl-formamide; for 18h; Further stages.; Heating;
DOI:10.1016/j.bmc.2008.08.025