3-(4-chlorophenyl)-4,5,6,7-tetrahydrobenzisoxazole

Base Information

• Chemical Name: 3-(4-chlorophenyl)-4,5,6,7-tetrahydrobenzisoxazole
• CAS No.: 61054-28-2
• Molecular Formula: C₁₃H₁₂ClNO
• Molecular Weight: 233.697
• Mol file: 61054-28-2.mol

Synonyms:3-(4-chlorophenyl)-4,5,6,7-tetrahydrobenzisoxazole

Chemical Property of 3-(4-chlorophenyl)-4,5,6,7-tetrahydrobenzisoxazole

Chemical Property:

Purity/Quality:

99% ^*data from raw suppliers

3-(4-Chlorophenyl)-4,5,6,7-tetrahydrobenzo[c]isoxazole 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 3-(4-chlorophenyl)-4,5,6,7-tetrahydrobenzisoxazole

There total 4 articles about 3-(4-chlorophenyl)-4,5,6,7-tetrahydrobenzisoxazole 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: 80.0%

2-(4'-chloro)benzoylcyclohexanone (38968-76-2) → 3-(4-chlorophenyl)-4,5,6,7-tetrahydrobenzisoxazole (61054-28-2)

Guidance literature:

With hydroxylamine-O-sulfonic acid; In methanol; Ambient temperature;

Reference yield: 70.0%

4,5,6,7-tetrahydro-2,1-benzisoxazole (2305-78-4) + 1-Chloro-4-iodobenzene (637-87-6) → 3-(4-chlorophenyl)-4,5,6,7-tetrahydrobenzisoxazole (61054-28-2)

Guidance literature:

With dichloro bis(acetonitrile) palladium(II); o-phenylenebis(diphenylphosphine); silver fluoride; In N,N-dimethyl acetamide; at 100 ℃; for 24h; Schlenk technique; Inert atmosphere; Darkness;

DOI:10.1002/anie.201504552

Reference yield:

cyclohexanone-oxime (100-64-1) + Methyl 4-chlorobenzoate (1126-46-1) → 3-(4-chlorophenyl)-4,5,6,7-tetrahydrobenzisoxazole (61054-28-2)

Guidance literature:

Multistep reaction; (i) nBuLi, THF, (ii) /BRN= 1564310/;

DOI:10.1002/jps.2600650939

upstream raw materials:

cyclohexanone-oxime

Methyl 4-chlorobenzoate

2-(4'-chloro)benzoylcyclohexanone

4,5,6,7-tetrahydro-2,1-benzisoxazole