Ethyl 5-(3,4-Dimethoxyphenyl)isoxazole-3-carboxylate

Base Information

Chemical Name:Ethyl 5-(3,4-Dimethoxyphenyl)isoxazole-3-carboxylate
CAS No.:371157-17-4
Molecular Formula:C₁₄H₁₅NO₅
Molecular Weight:277.277
Hs Code.:
DSSTox Substance ID:DTXSID60701662
Nikkaji Number:J1.682.962E
Wikidata:Q82633415
Mol file:371157-17-4.mol

Synonyms:371157-17-4;Ethyl 5-(3,4-Dimethoxyphenyl)isoxazole-3-carboxylate;SCHEMBL21523720;DTXSID60701662;MFCD09746152;SY267743;ethyl 5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carboxylate;5-(3,4-DIMETHOXYPHENYL)-3-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER

Suppliers and Price of Ethyl 5-(3,4-Dimethoxyphenyl)isoxazole-3-carboxylate

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
5-(3,4-DIMETHOXYPHENYL)-3-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER 95.00%
5MG
$ 497.54

Total 2 raw suppliers

Chemical Property of Ethyl 5-(3,4-Dimethoxyphenyl)isoxazole-3-carboxylate

Chemical Property:

PSA：70.79000
LogP:2.53550
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:277.09502258
Heavy Atom Count:20
Complexity:325

Purity/Quality:

98% ^*data from raw suppliers

5-(3,4-DIMETHOXYPHENYL)-3-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=NOC(=C1)C2=CC(=C(C=C2)OC)OC

Technology Process of Ethyl 5-(3,4-Dimethoxyphenyl)isoxazole-3-carboxylate

There total 5 articles about Ethyl 5-(3,4-Dimethoxyphenyl)isoxazole-3-carboxylate 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: 77.0%

: ethyl (Z)-4-(3,4-dimethoxyphenyl)-2-hydroxy-4-oxobut-2-enoate

: 371157-17-4
ethyl 5-(3,4-dimethoxyphenyl)-isoxazole-3-carboxylate

Guidance literature:: With hydroxylamine hydrochloride; In acetonitrile; at 70 ℃; for 3h;
DOI:10.1021/acs.joc.9b03399

Reference yield: 71.0%

: 14337-43-0
ethyl 2-chloro-2-(hydroxyimino)acetate

: 3,4-dimethoxyphenylcarbonyloxymethyl-Wang resin

: 371157-17-4
ethyl 5-(3,4-dimethoxyphenyl)-isoxazole-3-carboxylate

Guidance literature:: 3,4-dimethoxyphenylcarbonyloxymethyl-Wang resin; Tebbe reagent; In tetrahydrofuran; at 25 ℃; for 16h;

ethyl 2-chloro-2-(hydroxyimino)acetate; With triethylamine; In tetrahydrofuran;

With trifluoroacetic acid; In dichloromethane; at 25 ℃; Further stages.;
DOI:10.1021/ol016479x

Reference yield: 46.0%

: 371157-17-4
ethyl 5-(3,4-dimethoxyphenyl)-isoxazole-3-carboxylate

Guidance literature:: With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium carbonate; In water; acetonitrile; at 80 ℃; for 3h; Inert atmosphere;