2-(4-Chlorobenzylidene)cyclohexanone oxime

Base Information

• Chemical Name: 2-(4-Chlorobenzylidene)cyclohexanone oxime
• CAS No.: 41338-73-2
• Molecular Formula: C₁₃H₁₄ClNO
• Molecular Weight: 235.713
• Mol file: 41338-73-2.mol

Synonyms:2-(4-Chlorobenzylidene)cyclohexanone oxime;41338-73-2;NSC 159855;NSC159855;SCHEMBL9584369;(2E)-2-[(4-chlorophenyl)methylene]cyclohexanone oxime

Chemical Property of 2-(4-Chlorobenzylidene)cyclohexanone oxime

Chemical Property:

• Vapor Pressure: 2.12E-07mmHg at 25°C
• Boiling Point: 408.3°C at 760 mmHg
• Flash Point: 200.7°C
• Density: 1.2g/cm³
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 235.0763918
• Heavy Atom Count: 16
• Complexity: 290

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(=NO)C(=CC2=CC=C(C=C2)Cl)C1
• Isomeric SMILES: C1CC/C(=N\O)/C(=C/C2=CC=C(C=C2)Cl)/C1

Technology Process of 2-(4-Chlorobenzylidene)cyclohexanone oxime

There total 3 articles about 2-(4-Chlorobenzylidene)cyclohexanone oxime 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:

2-(4-chlorobenzylidene)cyclohexan-1-one (31020-78-7,31021-05-3,24765-16-0) → 2-[1-(4-Chloro-phenyl)-meth-(Z)-ylidene]-cyclohexanone oxime (41338-73-2)

Guidance literature:

With hydroxylamine hydrochloride; sodium acetate; In ethanol; water; at 60 ℃; for 1h; Yield given;

DOI:10.1002/jps.2600830619

Reference yield:

4-chlorobenzaldehyde (104-88-1) → 2-[1-(4-Chloro-phenyl)-meth-(Z)-ylidene]-cyclohexanone oxime (41338-73-2)

Guidance literature:

Multi-step reaction with 2 steps

1: NaOH / H₂O / 18 h / Heating

2: NH₂OH*HCl, AcONa / ethanol; H₂O / 1 h / 60 °C

With sodium hydroxide; hydroxylamine hydrochloride; sodium acetate; In ethanol; water;

DOI:10.1002/jps.2600830619

Reference yield:

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → 2-[1-(4-Chloro-phenyl)-meth-(Z)-ylidene]-cyclohexanone oxime (41338-73-2)

Guidance literature:

Multi-step reaction with 2 steps

1: NaOH / H₂O / 18 h / Heating

2: NH₂OH*HCl, AcONa / ethanol; H₂O / 1 h / 60 °C

With sodium hydroxide; hydroxylamine hydrochloride; sodium acetate; In ethanol; water;

DOI:10.1002/jps.2600830619

upstream raw materials:

2-(4-chlorobenzylidene)cyclohexan-1-one

cyclohexanone

4-chlorobenzaldehyde