2-Fluorophenyl cyclohexyl ketone

Base Information

• Chemical Name: 2-Fluorophenyl cyclohexyl ketone
• CAS No.: 106795-65-7
• Molecular Formula: C13H15FO
• Molecular Weight: 206.26
• Hs Code.: 2914700090
• DSSTox Substance ID: DTXSID00509386
• Wikidata: Q82366907
• Mol file: 106795-65-7.mol

Synonyms:2-FLUOROPHENYL CYCLOHEXYL KETONE;106795-65-7;cyclohexyl-(2-fluorophenyl)methanone;MFCD03841364;cyclohexyl(2-fluorophenyl)methanone;SCHEMBL716489;DTXSID00509386;2-FLUOROPHENYLCYCLOHEXYLKETONE;AKOS011792140

Chemical Property of 2-Fluorophenyl cyclohexyl ketone

Chemical Property:

• Vapor Pressure: 0.00161mmHg at 25°C
• Boiling Point: 294.6°C at 760 mmHg
• Flash Point: 119.8°C
• PSA: 17.07000
• Density: 1.099g/cm³
• LogP: 3.58870
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 206.110693260
• Heavy Atom Count: 15
• Complexity: 221

Purity/Quality:

97% ^*data from raw suppliers

2-FLUOROPHENYLCYCLOHEXYLKETONE ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)C(=O)C2=CC=CC=C2F

Technology Process of 2-Fluorophenyl cyclohexyl ketone

There total 9 articles about 2-Fluorophenyl cyclohexyl ketone 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: 68.0%

2-(o-fluorophenyl)-1-oxaspiro<2,5>octane (106795-61-3) → cyclohexyl(2-fluorophenyl)methanone (106795-65-7) + 1-(2-Fluoro-phenyl)-cyclohexanecarbaldehyde (106795-64-6)

Guidance literature:

With aluminium trichloride; In dichloromethane; for 0.05h; Yields of byproduct given; Ambient temperature;

Reference yield:

cyclohexyl(2-fluorophenyl)methanol → cyclohexyl(2-fluorophenyl)methanone (106795-65-7)

Guidance literature:

With Dess-Martin periodane; In dichloromethane; at 0 - 20 ℃;

DOI:10.3762/bjoc.9.171

Reference yield:

Cyclohexyl phenyl ketone (712-50-5) → cyclohexyl(2-fluorophenyl)methanone (106795-65-7)

Guidance literature:

With palladium diacetate; silver nitrate; N-fluorobis(benzenesulfon)imide; methyl carbamate; In dichloromethane; at 95 ℃; for 24h; Sealed tube;

DOI:10.1039/d1cc01047f

upstream raw materials:

2-(o-fluorophenyl)-1-oxaspiro<2,5>octane

cyclohexanone

[(2-fluorophenyl)methylene]triphenylphosphorane

o-fluorophenyl(cyclohexylidene)methane

Downstream raw materials:

C₁₅H₁₈OS

C₁₇H₂₀O₂S