5-Chloro-6-methyl-3-phenyl-2,1-benzisoxazole

Base Information

• Chemical Name: 5-Chloro-6-methyl-3-phenyl-2,1-benzisoxazole
• CAS No.: 35698-31-8
• Molecular Formula: C₁₄H₁₀ClNO
• Molecular Weight: 243.692
• European Community (EC) Number: 665-000-0

Synonyms:5-chloro-6-methyl-3-phenyl-2,1-benzisoxazole;35698-31-8;5-Chloro-6-methyl-3-phenylbenzo[c]isoxazole;SCHEMBL11863425;PLGFJTQMYDSPOS-UHFFFAOYSA-N;AKOS024324132

Chemical Property of 5-Chloro-6-methyl-3-phenyl-2,1-benzisoxazole

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 243.0450916
• Heavy Atom Count: 17
• Complexity: 267

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC2=NOC(=C2C=C1Cl)C3=CC=CC=C3

Technology Process of 5-Chloro-6-methyl-3-phenyl-2,1-benzisoxazole

There total 1 articles about 5-Chloro-6-methyl-3-phenyl-2,1-benzisoxazole 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:

→ 5-chloro-6-methyl-3-phenyl-benzo[c]isoxazole (35698-31-8)

Guidance literature:

4-Chlor-3-methylnitrobenzol, Phenylacetonitril;

Reference yield: 95.0%

5-chloro-6-methyl-3-phenyl-benzo[c]isoxazole (35698-31-8) → 2-amino-5-chloro-4-methyl-benzophenone (36243-96-6)

Guidance literature:

With trimethylsilyl iodide; water; In acetonitrile; at 20 ℃; for 0.4h;

Reference yield: 95.0%

5-chloro-6-methyl-3-phenyl-benzo[c]isoxazole (35698-31-8) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → Formic acid N-(6-benzoyl-4-chloro-3-methyl-cyclohexa-2,4-dienyl)-N',N'-dimethyl-hydrazide

Guidance literature:

With trichlorophosphate; for 3.5h; Ambient temperature;

DOI:10.1016/S0040-4039(00)95885-4

Downstream raw materials:

2-amino-5-chloro-4-methyl-benzophenone

(2-Amino-3,5-dichloro-4-methyl-phenyl)-phenyl-methanone

(5Z,11Z)-2,4,8,10-Tetrachloro-3,9-dimethyl-6,12-diphenyl-dibenzo[b,f][1,5]diazocine

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