4-[2-(5-Methyl-2-phenyl-4-oxazolyl)ethoxy]-benzo[b]thiophene-7-carbaldehyde

Base Information

Chemical Name:4-[2-(5-Methyl-2-phenyl-4-oxazolyl)ethoxy]-benzo[b]thiophene-7-carbaldehyde
CAS No.:475480-88-7
Molecular Formula:C21H17NO3S
Molecular Weight:363.437
Hs Code.:
European Community (EC) Number:934-914-4
DSSTox Substance ID:DTXSID80457790
Wikidata:Q82280797
Mol file:475480-88-7.mol

Synonyms:475480-88-7;4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]-benzo[b]thiophene-7-carbaldehyde;4-[2-(5-METHYL-2-PHENYL-1,3-OXAZOL-4-YL)ETHOXY]-1-BENZOTHIOPHENE-7-CARBALDEHYDE;Benzo[b]thiophene-7-carboxaldehyde, 4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]-;SCHEMBL5042459;DTXSID80457790;WAOPPOQPYOBXNE-UHFFFAOYSA-N;4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-benzo[b]thiophene-7-carbaldehyde;4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxyl]-benzo[b]thiophene-7-carbaldehyde;4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-benzo[b]thiophen-7-carbaldehyde

Suppliers and Price of 4-[2-(5-Methyl-2-phenyl-4-oxazolyl)ethoxy]-benzo[b]thiophene-7-carbaldehyde

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 4-[2-(5-Methyl-2-phenyl-4-oxazolyl)ethoxy]-benzo[b]thiophene-7-carbaldehyde

Chemical Property:

PSA：80.57000
LogP:5.29870
XLogP3:4.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:363.09291458
Heavy Atom Count:26
Complexity:470

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3=C4C=CSC4=C(C=C3)C=O

Technology Process of 4-[2-(5-Methyl-2-phenyl-4-oxazolyl)ethoxy]-benzo[b]thiophene-7-carbaldehyde

There total 2 articles about 4-[2-(5-Methyl-2-phenyl-4-oxazolyl)ethoxy]-benzo[b]thiophene-7-carbaldehyde 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: 83.0%

: 199339-71-4
4-hydroxy-benzo[b]thiophene-7-carboxaldehyde

: 227029-27-8
2-(2-phenyl-5-methyloxazole-4-yl)ethyl methanesulfonate

: 475480-88-7
4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-benzo[b]thiophene-7-carbaldehyde

Guidance literature:: 4-hydroxy-benzo[b]thiophene-7-carboxaldehyde; With potassium carbonate; In DMF (N,N-dimethyl-formamide); at 86 - 90 ℃; for 1h;

2-(2-phenyl-5-methyloxazole-4-yl)ethyl methanesulfonate; In DMF (N,N-dimethyl-formamide); at 86 - 90 ℃; for 6 - 7h;

Reference yield:

: 199339-71-4
4-hydroxy-benzo[b]thiophene-7-carboxaldehyde

: 103788-65-4
(5-methyl-2-phenyloxazol-4-yl)ethanol

: 475480-88-7
4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-benzo[b]thiophene-7-carbaldehyde

Guidance literature:: With di-isopropyl azodicarboxylate; triphenylphosphine; In toluene; at 20 ℃; for 2h;
DOI:10.1016/j.bmcl.2009.03.036

Reference yield: 91.0%

: 475480-88-7
4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-benzo[b]thiophene-7-carbaldehyde

: 6290-49-9
methyl methoxyacetate

: 849150-54-5
3-hydroxy-2-methoxy-3-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-benzo[b]thiophen-7-yl}-propionic acid methyl ester

Guidance literature:: methyl methoxyacetate; With lithium diisopropyl amide; In tetrahydrofuran; n-heptane; ethylbenzene; at -78 ℃; for 0.5h;

4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-benzo[b]thiophene-7-carbaldehyde; In tetrahydrofuran; n-heptane; dichloromethane; ethylbenzene; at -78 - 20 ℃; for 3.83333h; Product distribution / selectivity;