1-Butanone, 3,4-dichloro-1-cyclohexyl-

Base Information

• Chemical Name: 1-Butanone, 3,4-dichloro-1-cyclohexyl-
• CAS No.: 60444-22-6
• Molecular Formula: C10H16Cl2O
• Molecular Weight: 223.142
• DSSTox Substance ID: DTXSID00484629
• Mol file: 60444-22-6.mol

Synonyms:1-Butanone, 3,4-dichloro-1-cyclohexyl-;60444-22-6;DTXSID00484629

Chemical Property of 1-Butanone, 3,4-dichloro-1-cyclohexyl-

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 222.0578205
• Heavy Atom Count: 13
• Complexity: 164

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)C(=O)CC(CCl)Cl

Technology Process of 1-Butanone, 3,4-dichloro-1-cyclohexyl-

There total 4 articles about 1-Butanone, 3,4-dichloro-1-cyclohexyl- 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:

3-chloroprop-1-ene (107-05-1) + cyclohexanylcarbonyl chloride (2719-27-9) → 3,4-Dichloro-1-cyclohexyl-butan-1-one (60444-22-6)

Guidance literature:

With aluminium trichloride; In 1,2-dichloro-ethane; at 20 ℃; for 1h;

DOI:10.1007/BF00472476

Reference yield:

3-chloroprop-1-ene (107-05-1) + cyclohexanylcarbonyl chloride (2719-27-9) → 2-cyclohexylfuran (14174-48-2) + 3,4-Dichloro-1-cyclohexyl-butan-1-one (60444-22-6) + (E)-4-Chloro-1-cyclohexyl-but-2-en-1-one (136572-02-6) + 3-Chloro-1-cyclohexyl-but-3-en-1-one

Guidance literature:

With aluminium trichloride; In 1,2-dichloro-ethane; at -20 ℃; for 1h; Further byproducts given;

DOI:10.1007/BF00529363

Reference yield:

3-chloroprop-1-ene (107-05-1) + cyclohexanylcarbonyl chloride (2719-27-9) → 2-cyclohexylfuran (14174-48-2) + 3,4-Dichloro-1-cyclohexyl-butan-1-one (60444-22-6) + (E)-4-Chloro-1-cyclohexyl-but-2-en-1-one (136572-02-6) + (Z)-4-Chloro-1-cyclohexyl-but-3-en-1-one

Guidance literature:

With aluminium trichloride; In 1,2-dichloro-ethane; at -20 ℃; for 1h; Further byproducts given;

DOI:10.1007/BF00529363

upstream raw materials:

3-chloroprop-1-ene

cyclohexanylcarbonyl chloride

Downstream raw materials:

2-cyclohexylfuran

(E)-4-Chloro-1-cyclohexyl-but-2-en-1-one

2-(2-Cyclohexyl-pyrrol-1-yl)-ethanol

C₂₂H₃₂N₂