(2Z)-2-[(4-chlorophenyl)methylene]cyclohexanone

Base Information

• Chemical Name: (2Z)-2-[(4-chlorophenyl)methylene]cyclohexanone
• CAS No.: 24765-16-0
• Molecular Formula: C₁₃H₁₃ClO
• Molecular Weight: 220.699
• NSC Number: 145680
• Nikkaji Number: J2.805.319C
• Mol file: 24765-16-0.mol

Synonyms:24765-16-0;NSC145680;NSC 145680;2-(4-Chlorobenzylidene)cyclohexanone;SCHEMBL3438303;AKOS027461636;NSC-145680;2-[(Z)-4-Chlorobenzylidene]cyclohexane-1-one;(2Z)-2-[(4-chlorophenyl)methylene]cyclohexanone

Chemical Property of (2Z)-2-[(4-chlorophenyl)methylene]cyclohexanone

Chemical Property:

• Vapor Pressure: 1.41E-05mmHg at 25°C
• Boiling Point: 367°Cat760mmHg
• Flash Point: 194.4°C
• Density: 1.208g/cm³
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 220.0654927
• Heavy Atom Count: 15
• Complexity: 262

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(=O)C(=CC2=CC=C(C=C2)Cl)C1
• Isomeric SMILES: C1CCC(=O)/C(=C\C2=CC=C(C=C2)Cl)/C1

Technology Process of (2Z)-2-[(4-chlorophenyl)methylene]cyclohexanone

There total 10 articles about (2Z)-2-[(4-chlorophenyl)methylene]cyclohexanone 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: 88.0%

4-chlorobenzaldehyde (104-88-1) → 2-(4-chlorobenzylidene)cyclohexan-1-one (31020-78-7,31021-05-3,24765-16-0)

Guidance literature:

With sodium hydroxide; In hexane; water; cyclohexanone;

Reference yield: 88.0%

2-bromocyclohexanone (1056477-06-5,822-85-5) + 4-chlorobenzaldehyde (104-88-1) → 2-(4-chlorobenzylidene)cyclohexan-1-one (31020-78-7,31021-05-3,24765-16-0)

Guidance literature:

With aluminum oxide; zirconium(IV) chloride; microwave irradiation;

Reference yield:

C16H23ClO2Si → syn-2-[(4-chlorophenyl)(hydroxy)methyl]cyclohexan-1-one + 2-(4-chlorobenzylidene)cyclohexan-1-one (31020-78-7,31021-05-3,24765-16-0) + anti-2-[(4-chlorophenyl)(hydroxy)methyl]cyclohexan-1-one (13161-16-5,13161-17-6,61235-09-4,132556-37-7,132556-38-8)

Guidance literature:

C₁₆H₂₃ClO₂Si; With hydrogenchloride; In water;

at 20 ℃;

DOI:10.1039/c0ob00837k

upstream raw materials:

2-[hydroxy(4-chlorophenyl)methyl]cyclohexan-1-one

2-bromocyclohexanone

4-chlorobenzaldehyde

(2RS)-2-[(RS)-(4-chlorophenyl)(hydroxy)methyl]cyclohexanone

Downstream raw materials:

4-(4-Chloro-phenyl)-5,6,7,8-tetrahydro-quinazolin-2-ylamine

2-[1-(4-Chloro-phenyl)-meth-(Z)-ylidene]-cyclohexanone oxime

4-chloro-2'-hydroxydiphenylmethane

4-(4-chlorophenyl)-1,2,3,4,5,6,7,8-octahydroquinazoline-2-thione