2-(Methanesulfonyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

Base Information

Chemical Name:2-(Methanesulfonyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
CAS No.:63698-75-9
Molecular Formula:C12H14N2O6S
Molecular Weight:314.319
Hs Code.:
ChEMBL ID:CHEMBL387719
DSSTox Substance ID:DTXSID20569745
Wikidata:Q82456960

Synonyms:63698-75-9;CHEMBL387719;DTXSID20569745;2-(Methanesulfonyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

Suppliers and Price of 2-(Methanesulfonyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

Supply Marketing:

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

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Chemical Property of 2-(Methanesulfonyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

Chemical Property:

XLogP3:0.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:314.05725734
Heavy Atom Count:21
Complexity:426

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)S(=O)(=O)C

Technology Process of 2-(Methanesulfonyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

There total 3 articles about 2-(Methanesulfonyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole 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: 89.0%

: 23767-44-4
2-methylthio-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

: 63698-75-9
2-methanesulfonyl-5-(3,4,5-trimethoxy-phenyl)-[1,3,4]oxadiazole

Guidance literature:: With ammonium heptamolybdate; [bmim]PF₆; dihydrogen peroxide; at 40 ℃; for 2h;
DOI:10.1016/j.bmc.2007.04.014

Reference yield:

: 3291-03-0
3,4,5-trimethoxybenzohydrazide

: 63698-75-9
2-methanesulfonyl-5-(3,4,5-trimethoxy-phenyl)-[1,3,4]oxadiazole

Guidance literature:: Multi-step reaction with 3 steps

1: 64 percent / potassium hydroxide / ethanol / 8 h / Heating

2: 73 percent / aq. NaOH; indium tribromide / 4 h / 20 °C

3: 89 percent / [bmim]PF₆; (NH₄)6Mo₇O₂₄; aq. H₂O₂ / 2 h / 40 °C

With ammonium heptamolybdate; potassium hydroxide; sodium hydroxide; indium(III) bromide; [bmim]PF₆; dihydrogen peroxide; In ethanol;
DOI:10.1016/j.bmc.2007.04.014

Reference yield:

: 23269-92-3
5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole-2-thiol

: 63698-75-9
2-methanesulfonyl-5-(3,4,5-trimethoxy-phenyl)-[1,3,4]oxadiazole

Guidance literature:: Multi-step reaction with 2 steps

1: 73 percent / aq. NaOH; indium tribromide / 4 h / 20 °C

2: 89 percent / [bmim]PF₆; (NH₄)6Mo₇O₂₄; aq. H₂O₂ / 2 h / 40 °C

With ammonium heptamolybdate; sodium hydroxide; indium(III) bromide; [bmim]PF₆; dihydrogen peroxide;
DOI:10.1016/j.bmc.2007.04.014