4-[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]morpholine

Base Information

• Chemical Name: 4-[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]morpholine
• CAS No.: 29207-86-1
• Molecular Formula: C₁₂H₁₂ClN₃O₂
• Molecular Weight: 265.699
• DSSTox Substance ID: DTXSID001324089
• Nikkaji Number: J2.850.178A
• ChEMBL ID: CHEMBL1501691

Synonyms:4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]morpholine;29207-86-1;4-(5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl)morpholine;Maybridge3_005765;Oprea1_541566;MLS000861611;CHEMBL1501691;DTXSID001324089;HMS1447G01;HMS2777H04;STL554053;AKOS037503578;IDI1_017152;SMR000460395;CS-0336017;AP-970/43519411;2-(4-Chlorophenyl)-5-morpholino-1,3,4-oxadiazole;BRD-K55882439-001-08-4

Chemical Property of 4-[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]morpholine

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 265.0618043
• Heavy Atom Count: 18
• Complexity: 268

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1COCCN1C2=NN=C(O2)C3=CC=C(C=C3)Cl

Technology Process of 4-[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]morpholine

There total 5 articles about 4-[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]morpholine 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: 84.0%

4-chloromorpholine (23328-69-0) + 2-(4-chlorophenyl)-1,3,4-oxadiazole (23289-10-3) → 4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]morpholine (29207-86-1)

Guidance literature:

With [2,2]bipyridinyl; copper acetylacetonate; lithium tert-butoxide; In toluene; at 20 ℃; Inert atmosphere;

DOI:10.1021/ja101939r

Reference yield:

4-(benzoyloxy)morpholine (5765-65-1) + C16H8Cl2N4O2Zn*2MgCl2*2LiCl → 4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]morpholine (29207-86-1)

Guidance literature:

With copper(II) bis(trifluoromethanesulfonate); In tetrahydrofuran; at 25 ℃; for 2h; Inert atmosphere;

DOI:10.1021/acs.orglett.0c00238

Reference yield:

N'-[chloro-(4-chloro-phenyl)-methylene]-morpholine-4-carbohydrazonoyl chloride (29207-85-0) → 4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]morpholine (29207-86-1)

Guidance literature:

With water; In 1,4-dioxane;

DOI:10.1016/S0040-4039(01)98670-8

upstream raw materials:

morpholine-4-carboxylic acid (4-chloro-benzylidene)-hydrazide

N'-[chloro-(4-chloro-phenyl)-methylene]-morpholine-4-carbohydrazonoyl chloride

4-chloro-N'-dichloromethylene-benzohydrazonoyl chloride

4-chloromorpholine

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