5-Isoxazolecarboxylic acid, 2,3-dihydro-2-methyl-3-phenyl-, methyl ester

Base Information

Chemical Name:5-Isoxazolecarboxylic acid, 2,3-dihydro-2-methyl-3-phenyl-, methyl ester
CAS No.:87352-10-1
Molecular Formula:C12H13NO3
Molecular Weight:219.24
Hs Code.:
DSSTox Substance ID:DTXSID70470392

Synonyms:87352-10-1;Methyl 2-methyl-3-phenyl-2,3-dihydroisoxazole-5-carboxylate;5-Isoxazolecarboxylic acid, 2,3-dihydro-2-methyl-3-phenyl-, methyl ester;DTXSID70470392

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 5-Isoxazolecarboxylic acid, 2,3-dihydro-2-methyl-3-phenyl-, methyl ester

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:219.08954328
Heavy Atom Count:16
Complexity:295

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(C=C(O1)C(=O)OC)C2=CC=CC=C2

Technology Process of 5-Isoxazolecarboxylic acid, 2,3-dihydro-2-methyl-3-phenyl-, methyl ester

There total 5 articles about 5-Isoxazolecarboxylic acid, 2,3-dihydro-2-methyl-3-phenyl-, methyl 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: 70.0%

: 87190-57-6
trans-N-Methyl-5-carbomethoxy-4-nitro-trans-3-phenylisoxazolidine

: 87352-10-1
N-methyl-5-carbomethoxy-3-phenyl-4,5-dehydroisoxazolidine

Guidance literature:: With potassium tert-butylate; In dimethyl sulfoxide; for 6h; Ambient temperature;
DOI:10.1021/jo00176a013

Reference yield: 60.0%

: 3376-23-6,7372-59-0,59862-60-1
C-phenyl-N-methylnitrone

: 922-67-8
propynoic acid methyl ester

: 109787-19-1
4-carbomethoxy-N-methyl-3-phenyl-4,5-dehydroisoxazolidine

: 87352-10-1
N-methyl-5-carbomethoxy-3-phenyl-4,5-dehydroisoxazolidine

Guidance literature:: In benzene; for 12h; Heating;
DOI:10.1021/jo00176a013

Reference yield:

: 932-90-1
Benzaldoxime

: 87352-10-1
N-methyl-5-carbomethoxy-3-phenyl-4,5-dehydroisoxazolidine

Guidance literature:: Multi-step reaction with 2 steps

1: 12 h / 0 °C

2: cesium fluoride / 1,2-dimethoxy-ethane

With cesium fluoride; In 1,2-dimethoxyethane;
DOI:10.1021/jo00279a036