(1R)-1-(3-Oxobutyl)-2-oxocyclohexanecarboxylic acid ethyl ester

Base Information

Chemical Name:(1R)-1-(3-Oxobutyl)-2-oxocyclohexanecarboxylic acid ethyl ester
CAS No.:69881-57-8
Molecular Formula:C13H20O4
Molecular Weight:240.299
Hs Code.:
DSSTox Substance ID:DTXSID50453087
Nikkaji Number:J688.281A
Wikidata:Q82274078

Synonyms:CTK1J0647;69881-57-8;DTXSID50453087;(1R)-1-(3-Oxobutyl)-2-oxocyclohexanecarboxylic acid ethyl ester

Suppliers and Price of (1R)-1-(3-Oxobutyl)-2-oxocyclohexanecarboxylic acid ethyl 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 1 raw suppliers

Chemical Property of (1R)-1-(3-Oxobutyl)-2-oxocyclohexanecarboxylic acid ethyl ester

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:240.13615911
Heavy Atom Count:17
Complexity:321

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1(CCCCC1=O)CCC(=O)C
Isomeric SMILES:CCOC(=O)[C@]1(CCCCC1=O)CCC(=O)C

Technology Process of (1R)-1-(3-Oxobutyl)-2-oxocyclohexanecarboxylic acid ethyl ester

There total 35 articles about (1R)-1-(3-Oxobutyl)-2-oxocyclohexanecarboxylic acid ethyl 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: 100.0%

: 78-94-4,25038-87-3
methyl vinyl ketone

: 1655-07-8
ethyl 2-oxocyclohexane carboxylate

: 69881-57-8,69881-58-9,111136-34-6,61771-80-0
2-oxo-1-(3-oxo-butyl)-cyclohexanecarboxylic acid ethyl ester

Guidance literature:: Amberlyst A-26 ion-exchange resin hydroxyl form; In water; at 25 ℃; for 3h;

Reference yield: 95.0%

: 151-50-8
potassium cyanide

: 78-94-4,25038-87-3
methyl vinyl ketone

: 1655-07-8
ethyl 2-oxocyclohexane carboxylate

: 69881-57-8,69881-58-9,111136-34-6,61771-80-0
2-oxo-1-(3-oxo-butyl)-cyclohexanecarboxylic acid ethyl ester

Guidance literature:: 1-azoniatricyclo<4.4.4.0^1,6>tetradecane hydroxide; In dichloromethane; at 25 ℃; for 1h;

Reference yield: 90.0%

: 78-94-4,25038-87-3
methyl vinyl ketone

: 302800-27-7
N-(2-Ethoxycarbonyl-1-cyclohexenyl)-L-valine diethylamide

: 69881-57-8
(+)-(R)-2-Oxo-1-(3-oxo-1-butyl)-cyclohexancarbonsaeureaethylester

Guidance literature:: N-(2-Ethoxycarbonyl-1-cyclohexenyl)-L-valine diethylamide; With copper diacetate; In acetone; at 23 ℃; for 0.75h;

methyl vinyl ketone; In acetone; at 23 ℃;

With hydrogenchloride; at 0 ℃; Further stages.;
DOI:10.1002/1521-3765(20010302)7:5<1014::AID-CHEM1014>3.0.CO;2-X