5-(chloromethyl)-3-cyclohexyl-isoxazole

Base Information

• Chemical Name: 5-(chloromethyl)-3-cyclohexyl-isoxazole
• CAS No.: 64988-76-7
• Molecular Formula: C10H14ClNO
• Molecular Weight: 199.68
• Hs Code.: 2934999090

Synonyms:5-chloromethyl-3-cyclohexyl-isoxazole;

Chemical Property of 5-(chloromethyl)-3-cyclohexyl-isoxazole

Chemical Property:

• Vapor Pressure: 0.000527mmHg at 25°C
• Boiling Point: 322.4oC at 760 mmHg
• Flash Point: 148.8oC
• PSA: 26.03000
• Density: 1.145g/cm3
• LogP: 3.46110

Purity/Quality:

99% ^*data from raw suppliers

5-(chloromethyl)-3-cyclohexylisoxazole ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T
• Statements: 25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 5-(chloromethyl)-3-cyclohexyl-isoxazole

There total 7 articles about 5-(chloromethyl)-3-cyclohexyl-isoxazole 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%

3-chloro-1-cyclohexylbut-3-en-1-one oxime → 5-(chloromethyl)-3-cyclohexylisoxazole (64988-76-7)

Guidance literature:

With 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; [bis(acetoxy)iodo]benzene; In acetonitrile; at 25 ℃; Sealed tube; Inert atmosphere;

DOI:10.1021/acs.orglett.8b00967

Reference yield:

2,3-Dichloroprop-1-ene (78-88-6) + N-hydroxycyclohex-1-carbonimidoyl chloride (55278-53-0) → 5-(chloromethyl)-3-cyclohexylisoxazole (64988-76-7)

Guidance literature:

With triethylamine; at 20 ℃; for 1h;

DOI:10.1007/s10593-019-02606-2

Reference yield:

3-Chloro-1-cyclohexyl-but-3-en-1-one → 5-(chloromethyl)-3-cyclohexylisoxazole (64988-76-7)

Guidance literature:

Multi-step reaction with 2 steps

1: pyridine; hydroxylamine hydrochloride / ethanol / 25 °C

2: [bis(acetoxy)iodo]benzene; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical / acetonitrile / 25 °C / Sealed tube; Inert atmosphere

With pyridine; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; [bis(acetoxy)iodo]benzene; hydroxylamine hydrochloride; In ethanol; acetonitrile;

DOI:10.1021/acs.orglett.8b00967

upstream raw materials:

2,3-dichloropropenyl cyclohexyl ketone

cyclohexanecarbaldehyde

cyclohexanecarbaldoxime

2,3-Dichloroprop-1-ene

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