Methyl 3-(4-fluorophenyl)-1,2,4-oxadiazole-5-carboxylate

Base Information

Chemical Name:Methyl 3-(4-fluorophenyl)-1,2,4-oxadiazole-5-carboxylate
CAS No.:861146-13-6
Molecular Formula:C₁₀H₇FN₂O₃
Molecular Weight:222.176
Hs Code.:
DSSTox Substance ID:DTXSID801202536

Synonyms:861146-13-6;methyl 3-(4-fluorophenyl)-1,2,4-oxadiazole-5-carboxylate;1,2,4-Oxadiazole-5-carboxylic acid, 3-(4-fluorophenyl)-, methyl ester;DTXSID801202536;STK278191;AKOS005426071;CCG-345356;MCULE-3435040728;NCGC00330264-01;AB01324807-02;methyl3-(4-fluorophenyl)-1,2,4-oxadiazole-5-carboxylate

Suppliers and Price of Methyl 3-(4-fluorophenyl)-1,2,4-oxadiazole-5-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
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Total 1 raw suppliers

Chemical Property of Methyl 3-(4-fluorophenyl)-1,2,4-oxadiazole-5-carboxylate

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:222.04407025
Heavy Atom Count:16
Complexity:256

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C1=NC(=NO1)C2=CC=C(C=C2)F

Technology Process of Methyl 3-(4-fluorophenyl)-1,2,4-oxadiazole-5-carboxylate

There total 1 articles about Methyl 3-(4-fluorophenyl)-1,2,4-oxadiazole-5-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:

: 1194-02-1,143234-87-1
4-fluorobenzonitrile

: 861146-13-6
3-(4-fluoro-phenyl)-[1,2,4]oxadiazole-5-carboxylic acid methyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: hydroxylamine hydrochloride; sodium carbonate / water; methanol / 4 h / Reflux

2: tetrahydrofuran / 4.5 h / Reflux

With hydroxylamine hydrochloride; sodium carbonate; In tetrahydrofuran; methanol; water;
DOI:10.1016/j.bmc.2012.08.047

Reference yield:

: 861146-13-6
3-(4-fluoro-phenyl)-[1,2,4]oxadiazole-5-carboxylic acid methyl ester

: 861146-16-9
3-(4-fluorophenyl)-1,2,4-oxadiazole-5-carbohydrazide

Guidance literature:: With hydrazine hydrate; In ethanol; for 2h; cooling;
DOI:10.1515/HC.2005.11.1.29

Reference yield:

: 861146-13-6
3-(4-fluoro-phenyl)-[1,2,4]oxadiazole-5-carboxylic acid methyl ester

: 3-(4-fluorophenyl)-N'-[(4-hydroxy-3-methoxyphenyl)methylene]-1,2,4-oxadiazole-5-carbohydrazide

Guidance literature:: Multi-step reaction with 2 steps

1: hydrazine hydrate / ethanol / 2 h / 0 °C

2: sulfuric acid / ethanol / 0.17 h / 20 °C

With hydrazine hydrate; sulfuric acid; In ethanol;
DOI:10.1016/j.bmc.2012.08.047