5-(1-(4-Isobutylphenyl)ethyl)-1,3,4-oxadiazole-2-thiol

Base Information

Chemical Name:5-(1-(4-Isobutylphenyl)ethyl)-1,3,4-oxadiazole-2-thiol
CAS No.:127222-70-2
Molecular Formula:C₁₄H₁₈N₂OS
Molecular Weight:262.376
Hs Code.:
DSSTox Substance ID:DTXSID101161022
Nikkaji Number:J971.230E

Synonyms:5-(1-(4-isobutylphenyl)ethyl)-1,3,4-oxadiazole-2-thiol;5-[1-(4-Isobutylphenyl)ethyl]-1,3,4-oxadiazole-2-thiol;DTXSID101161022;TOD101060;5-[1-[4-(2-Methylpropyl)phenyl]ethyl]-1,3,4-oxadiazole-2(3H)-thione;5-{1-[4-(2-methylpropyl)phenyl]ethyl}-2,3-dihydro-1,3,4-oxadiazole-2-thione;127222-70-2

Suppliers and Price of 5-(1-(4-Isobutylphenyl)ethyl)-1,3,4-oxadiazole-2-thiol

Supply Marketing:

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

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Chemical Property of 5-(1-(4-Isobutylphenyl)ethyl)-1,3,4-oxadiazole-2-thiol

Chemical Property:

XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:262.11398438
Heavy Atom Count:18
Complexity:333

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)CC1=CC=C(C=C1)C(C)C2=NNC(=S)O2

Technology Process of 5-(1-(4-Isobutylphenyl)ethyl)-1,3,4-oxadiazole-2-thiol

There total 3 articles about 5-(1-(4-Isobutylphenyl)ethyl)-1,3,4-oxadiazole-2-thiol 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: 85.0%

: 75-15-0,12122-00-8
carbon disulfide

: 127222-69-9
ibuprofen hydrazide

: 127222-70-2
5-(1-(4-isobutylphenyl)ethyl)-1,3,4-oxadiazole-2(3H)-thione

Guidance literature:: With potassium hydroxide; In ethanol; for 4h; Reflux;
DOI:10.1016/j.ejmech.2010.08.039

Reference yield:

: 61566-34-5
(+/-)-ibuprofen methyl ester

: 127222-70-2
5-(1-(4-isobutylphenyl)ethyl)-1,3,4-oxadiazole-2(3H)-thione

Guidance literature:: Multi-step reaction with 2 steps

1: hydrazine hydrate / ethanol / Reflux

2: potassium hydroxide

With hydrazine hydrate; potassium hydroxide; In ethanol;
DOI:10.1016/j.bioorg.2016.09.005

Reference yield:

: 15687-27-1,58560-75-1
ibuprofen

: 127222-70-2
5-(1-(4-isobutylphenyl)ethyl)-1,3,4-oxadiazole-2(3H)-thione

Guidance literature:: Multi-step reaction with 3 steps

1: sulfuric acid / Reflux

2: hydrazine hydrate / ethanol / Reflux

3: potassium hydroxide

With sulfuric acid; hydrazine hydrate; potassium hydroxide; In ethanol;
DOI:10.1016/j.bioorg.2016.09.005