2-(2-Chlorophenyl)-5-(2,6-dichlorophenyl)-1,3,4-oxadiazole

Base Information

• Chemical Name: 2-(2-Chlorophenyl)-5-(2,6-dichlorophenyl)-1,3,4-oxadiazole
• CAS No.: 90017-06-4
• Molecular Formula: C₁₄H₇Cl₃N₂O
• Molecular Weight: 325.581
• DSSTox Substance ID: DTXSID40520838
• Wikidata: Q82384972

Synonyms:90017-06-4;2-(2-Chlorophenyl)-5-(2,6-dichlorophenyl)-1,3,4-oxadiazole;DTXSID40520838

Chemical Property of 2-(2-Chlorophenyl)-5-(2,6-dichlorophenyl)-1,3,4-oxadiazole

Chemical Property:

• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 323.962396
• Heavy Atom Count: 20
• Complexity: 324

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C2=NN=C(O2)C3=C(C=CC=C3Cl)Cl)Cl

Technology Process of 2-(2-Chlorophenyl)-5-(2,6-dichlorophenyl)-1,3,4-oxadiazole

There total 2 articles about 2-(2-Chlorophenyl)-5-(2,6-dichlorophenyl)-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: 76.0%

2,6-Dichloro-benzoic acid [1-(2-chloro-phenyl)-1-cyano-meth-(Z)-ylidene]-hydrazide (90017-03-1) → 2-(2-Chloro-phenyl)-5-(2,6-dichloro-phenyl)-[1,3,4]oxadiazole (90017-06-4)

Guidance literature:

With dimethyl sulfoxide; for 2h; Heating;

DOI:10.1055/s-1984-30760

Reference yield: 17.0%

2,6-Dichloro-benzoic acid [1-(2-chloro-phenyl)-1-cyano-meth-(Z)-ylidene]-hydrazide (90017-03-1) + dimethyl sulfoxide (67-68-5,8070-53-9) → 2-(2-Chloro-phenyl)-5-(2,6-dichloro-phenyl)-[1,3,4]oxadiazole (90017-06-4) + 2,6-Dichloro-benzoic acid N'-[1-(2-chloro-phenyl)-1-cyano-meth-(Z)-ylidene]-N-methylsulfanylmethyl-hydrazide (90017-14-4)

Guidance literature:

for 0.2h; Heating;

DOI:10.1055/s-1984-30760

upstream raw materials:

2,6-Dichloro-benzoic acid [1-(2-chloro-phenyl)-1-cyano-meth-(Z)-ylidene]-hydrazide

dimethyl sulfoxide

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