1-(4-Fluorophenyl)-3-phenylprop-2-yn-1-one

Base Information

• Chemical Name: 1-(4-Fluorophenyl)-3-phenylprop-2-yn-1-one
• CAS No.: 82677-84-7
• Molecular Formula: C15H9FO
• Molecular Weight: 224.234
• European Community (EC) Number: 866-412-5
• Nikkaji Number: J1.331.870K

Synonyms:1-(4-fluorophenyl)-3-phenylprop-2-yn-1-one;82677-84-7;UNM-0000306059;SCHEMBL13284136;BDBM54701;cid_13200052;MFCD03249461;AKOS025116473;LS-09740;UNM000011087501;1-(4-fluorophenyl)-3-phenyl-2-propyn-1-one;3-phenyl-1-(4-fluorophenyl)prop-2-yn-1-one;1-(4-fluorophenyl)-3-phenyl-prop-2-yn-1-one

Chemical Property of 1-(4-Fluorophenyl)-3-phenylprop-2-yn-1-one

Chemical Property:

• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 224.063743068
• Heavy Atom Count: 17
• Complexity: 321

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C#CC(=O)C2=CC=C(C=C2)F

Technology Process of 1-(4-Fluorophenyl)-3-phenylprop-2-yn-1-one

There total 40 articles about 1-(4-Fluorophenyl)-3-phenylprop-2-yn-1-one 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: 98.0%

4-fluorobenzaldehyde (459-57-4) + tetrakis(phenylethynyl)tin (21890-32-4) → 1-(4-fluorophenyl)-3-phenylprop-2-yn-1-one (82677-84-7)

Guidance literature:

With zinc(II) chloride; In toluene; at 60 ℃; for 5h;

DOI:10.1134/S1070363217070295

Reference yield: 96.0%

4-fluorobenzoyl chloride (403-43-0) + phenylacetylene (536-74-3) → 1-(4-fluorophenyl)-3-phenylprop-2-yn-1-one (82677-84-7)

Guidance literature:

With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine; In tetrahydrofuran; at 20 ℃; for 3h; Inert atmosphere;

DOI:10.1021/jo201259j

Reference yield: 95.0%

1-(4-fluorophenyl)-3-phenylprop-2-yn-1-ol (142739-41-1) → 1-(4-fluorophenyl)-3-phenylprop-2-yn-1-one (82677-84-7)

Guidance literature:

With manganese(IV) oxide; In acetone; at 20 ℃; for 0.5h; Inert atmosphere;

DOI:10.1021/jo5008702

upstream raw materials:

4-fluorobenzoyl chloride

diphenyl(phenylethynyl)stibine

4-fluoro-1-iodobenzene

carbon monoxide

Downstream raw materials:

2-(4-fluorophenyl)-2-(2-phenylethynyl)-1,3-dithiolane

(E)-4-fluoro-1-(4-fluorophenyl)-3-phenyl-4,4-bis(phenylsulfonyl)but-2-en-1-one

1-acetyl-5-(4-fluorophenyl)-5-hydroxy-3-phenyl-4,5-dihydro-1H-pyrazole

(2E,4E,6E)-4-(4-fluorobenzoyl)-N₁,N₁,N₈,N₈-tetramethyl-5-phenylocta-2,4,6-trienediamide

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