1-(4-(Methylthio)phenyl)-2-phenylethanone

Base Information

• Chemical Name: 1-(4-(Methylthio)phenyl)-2-phenylethanone
• CAS No.: 73242-07-6
• Molecular Formula: C15H14OS
• Molecular Weight: 242.342
• DSSTox Substance ID: DTXSID20375020
• Nikkaji Number: J1.897.704D
• Wikidata: Q82163569

Synonyms:1-(4-(methylthio)phenyl)-2-phenylethanone;73242-07-6;1-(4-methylsulfanylphenyl)-2-phenylethanone;Ethanone, 1-[4-(methylthio)phenyl]-2-phenyl-;1-[4-(Methylthio)phenyl]-2-phenylethanone;SCHEMBL3939694;DTXSID20375020;XTSWQXIWFZTMJR-UHFFFAOYSA-N;STL301478;AKOS017559889;2-phenyl-1-(4-methylthiophenyl)ethanone;1-(4-Methylthiophenyl)-2-phenyl-ethanone;1-(4-Methylsulfanyl-phenyl)-2-phenyl-ethanone;1-[4-(methylsulfanyl)phenyl]-2-phenylethanone

Chemical Property of 1-(4-(Methylthio)phenyl)-2-phenylethanone

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 242.07653624
• Heavy Atom Count: 17
• Complexity: 237

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CSC1=CC=C(C=C1)C(=O)CC2=CC=CC=C2

Technology Process of 1-(4-(Methylthio)phenyl)-2-phenylethanone

There total 13 articles about 1-(4-(Methylthio)phenyl)-2-phenylethanone 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: 97.0%

methyl-phenyl-thioether (100-68-5) + phenylacetyl chloride (103-80-0) → 2-phenyl-4'-(methylthio)acetophenone (73242-07-6)

Guidance literature:

methyl-phenyl-thioether; phenylacetyl chloride; With aluminum (III) chloride; In dichloromethane; at 20 ℃; for 2.75h; Cooling with ice; Inert atmosphere;

With hydrogenchloride; In dichloromethane; water;

DOI:10.1021/jm500483b

Reference yield: 85.0%

1-(2-methoxyvinyl)benzene (4747-15-3) + 1-[4-(methylsulfanyl)phenyl]diazonium tetrafluoroborate → 2-phenyl-4'-(methylthio)acetophenone (73242-07-6)

Guidance literature:

With palladium diacetate; In tetrahydrofuran; at 20 ℃; for 2h; regioselective reaction;

DOI:10.1039/d1ob01503f

Reference yield: 76.3%

phenylacetic acid (103-82-2) + methyl-phenyl-thioether (100-68-5) → 2-phenyl-4'-(methylthio)acetophenone (73242-07-6)

Guidance literature:

With phosphoric acid; trifluoroacetic anhydride; at 25 ℃; for 0.0166667h;

DOI:10.1007/s00044-011-9646-9

upstream raw materials:

methyl-phenyl-thioether

phenylacetyl chloride

aluminium trichloride

phenylacetic acid

Downstream raw materials:

2,2-dimethyl-5-[4-(methylthio)phenyl]-4-phenyl-3(2H)-furanone

2-bromo-1-(4''-(methylsulfanyl)phenyl)-2-phenyl-1-ethanone

C₂₄H₂₃N₃S

C₂₃H₂₀ClN₃S

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