Ethyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate

Base Information

Chemical Name:Ethyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate
CAS No.:92029-29-3
Molecular Formula:C13H13NO3
Molecular Weight:231.251
Hs Code.:
DSSTox Substance ID:DTXSID70554303
Wikidata:Q82435246
Mol file:92029-29-3.mol

Synonyms:92029-29-3;ETHYL 3-METHYL-5-PHENYL-1,2-OXAZOLE-4-CARBOXYLATE;4-Isoxazolecarboxylic acid, 3-methyl-5-phenyl-, ethyl ester;Ethyl 3-methyl-5-phenylisoxazole-4-carboxylate;3-Methyl-5-phenyl-4-Isoxazolecarboxylicacid ethylester;SCHEMBL4031918;DTXSID70554303;MMEZWYVJDPVZAY-UHFFFAOYSA-N;A19320;ethyl 3-methyl-5-phenyl-4-isoxazole carboxylate

Suppliers and Price of Ethyl 3-methyl-5-phenyl-1,2-oxazole-4-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

Total 7 raw suppliers

Chemical Property of Ethyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate

Chemical Property:

PSA：52.33000
LogP:2.82670
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:231.08954328
Heavy Atom Count:17
Complexity:263

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=C(ON=C1C)C2=CC=CC=C2

Technology Process of Ethyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate

There total 8 articles about Ethyl 3-methyl-5-phenyl-1,2-oxazole-4-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: 76.4%

: 569-37-9
ethyl 3-oxo-2-benzoylbutanoate

: 92029-29-3
ethyl 3-methyl-5-phenylisoxazole-4-carboxylate

Guidance literature:: With hydroxylamine hydrochloride; In ethanol; water; at 60 ℃;
DOI:10.1021/jm2013503

Reference yield:

: 98-88-4
benzoyl chloride

: 92029-29-3
ethyl 3-methyl-5-phenylisoxazole-4-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: diethyl ether; pyridine

2: alcohol; hydroxylamine hydrochloride

With pyridine; diethyl ether; ethanol; hydroxylamine hydrochloride;

Reference yield:

: 141-97-9
ethyl acetoacetate

: 92029-29-3
ethyl 3-methyl-5-phenylisoxazole-4-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium hydroxide / Petroleum ether / 0.5 h / 0 °C

1.2: 2 h / 0 - 35 °C

2.1: hydroxylamine hydrochloride / ethanol; water / 60 °C

With hydroxylamine hydrochloride; sodium hydroxide; In ethanol; water; Petroleum ether;
DOI:10.1021/jm2013503