Ethyl 4-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-alpha-ethylbenzeneacetate

Base Information

Chemical Name:Ethyl 4-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-alpha-ethylbenzeneacetate
CAS No.:36691-02-8
Molecular Formula:C₂₀H₂₁NO₃
Molecular Weight:323.392
Hs Code.:
European Community (EC) Number:609-283-0
DSSTox Substance ID:DTXSID501165290

Synonyms:Oprea1_231245;36691-02-8;SCHEMBL11642836;DTXSID501165290

Suppliers and Price of Ethyl 4-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-alpha-ethylbenzeneacetate

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 5 raw suppliers

Chemical Property of Ethyl 4-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-alpha-ethylbenzeneacetate

Chemical Property:

XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:323.15214353
Heavy Atom Count:24
Complexity:456

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCC(C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O)C(=O)OCC

Technology Process of Ethyl 4-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-alpha-ethylbenzeneacetate

There total 9 articles about Ethyl 4-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-alpha-ethylbenzeneacetate 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: 63.0%

: ethyl 2-(4-(isoindolin-2-yl)phenyl)butanoate

: 36691-02-8
ethyl 2-(4-(1-oxoisoindolin-2-yl)phenyl)butanoate

Guidance literature:: With oxygen; potassium carbonate; In dimethyl sulfoxide; at 20 ℃; for 24h; Irradiation; Green chemistry;
DOI:10.1039/c9gc02870f

Reference yield:

: 74-96-4
ethyl bromide

: 36691-01-7
ethyl 2-(4-(1-oxoisoindolin-2-yl)phenyl)acetate

: 36691-02-8
ethyl 2-(4-(1-oxoisoindolin-2-yl)phenyl)butanoate

Guidance literature:: With potassium carbonate; In tetrahydrofuran; at -10 - 100 ℃;

Reference yield:

: 496-12-8
isoindoline

: 36691-02-8
ethyl 2-(4-(1-oxoisoindolin-2-yl)phenyl)butanoate

Guidance literature:: Multi-step reaction with 2 steps

1: potassium tert-butylate; 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl; palladium diacetate / toluene / 0.5 h / 100 °C / Inert atmosphere

2: 1,4-diaza-bicyclo[2.2.2]octane; 5-methyl-2-furanone; oxygen / tetrahydrofuran / 36 h / 25 °C

With 1,4-diaza-bicyclo[2.2.2]octane; 5-methyl-2-furanone; potassium tert-butylate; oxygen; palladium diacetate; 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl; In tetrahydrofuran; toluene;
DOI:10.1021/acs.orglett.9b00224