1-(5-Acetyl-2,4-dimethoxyphenyl)ethanone

Base Information

• Chemical Name: 1-(5-Acetyl-2,4-dimethoxyphenyl)ethanone
• CAS No.: 3098-67-7
• Molecular Formula: C12H14 O4
• Molecular Weight: 222.241
• Hs Code.: 2914509090
• European Community (EC) Number: 673-655-9
• DSSTox Substance ID: DTXSID80374135
• Wikidata: Q82162633
• Mol file: 3098-67-7.mol

Synonyms:3098-67-7;1-(5-acetyl-2,4-dimethoxyphenyl)ethanone;1,3-Diacetyl-4,6-dimethoxybenzene;1-(5-acetyl-2,4-dimethoxyphenyl)ethan-1-one;1,1'-(4,6-dimethoxybenzene-1,3-diyl)diethanone;Ethanone, 1,1'-(4,6-dimethoxy-1,3-phenylene)bis-;1,1'-(4,6-Dimethoxy-1,3-phenylene)diethanone;DTXSID80374135;MFCD01926551;STL253545;AKOS000446927;1-(5-acetyl-2,4-dimethoxy-phenyl)ethanone;CS-0234573;EN300-14357;1-(5-acetyl-2,4-dimethoxyphenyl)-1-ethanone;A820678;1,1'-(4,6-Dimethoxy-1,3-phenylene)di(ethan-1-one);Z104510670

Chemical Property of 1-(5-Acetyl-2,4-dimethoxyphenyl)ethanone

Chemical Property:

• Boiling Point: 373.9°Cat760mmHg
• Flash Point: 167°C
• PSA: 52.60000
• Density: 1.108g/cm³
• LogP: 2.10900
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 222.08920892
• Heavy Atom Count: 16
• Complexity: 248

Purity/Quality:

98%Min ^*data from raw suppliers

1,1'-(4,6-Dimethoxy-1,3-phenylene)diethanone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC(=C(C=C1OC)OC)C(=O)C

Technology Process of 1-(5-Acetyl-2,4-dimethoxyphenyl)ethanone

There total 7 articles about 1-(5-Acetyl-2,4-dimethoxyphenyl)ethanone 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: 87.0%

1-(5-acetyl-2,4-dihydroxyphenyl)-1-ethanone (2161-85-5) + methyl iodide (74-88-4) → 1,1'-(4,6-dimethoxy-1,3-phenylene)diethanone (3098-67-7)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 16h;

DOI:10.1515/hc-2017-0129

Reference yield: 74.0%

1-(5-acetyl-2,4-dihydroxyphenyl)-1-ethanone (2161-85-5) + dimethyl sulfate (77-78-1) → 1,1'-(4,6-dimethoxy-1,3-phenylene)diethanone (3098-67-7)

Guidance literature:

With potassium carbonate; In acetone; for 6h; Reflux;

DOI:10.1007/s00044-012-0137-4

Reference yield:

aluminium trichloride (7446-70-0) + 1-(4-acetoxy-2-methoxy-phenyl)-ethanone (91143-38-3) + nitrobenzene (98-95-3,26969-40-4) → 1,1'-(4,6-dimethoxy-1,3-phenylene)diethanone (3098-67-7) + 2',4'-dimethoxyacetophenone (829-20-9)

Guidance literature:

und Behandeln des Reaktionsprodukts in Aceton mit Dimethylsulfat und wss.NaOH;

DOI:10.1039/jr9340001681

upstream raw materials:

1-(5-acetyl-2,4-dihydroxyphenyl)-1-ethanone

dimethyl sulfate

acetyl chloride

1,3-Dimethoxybenzene

Downstream raw materials:

1,5-dimethoxy-2,4-bis-(3-oxo-3-phenyl-propionyl)-benzene

1,5-diacetoxy-2,4-dimethoxy-benzene

2,4-diethyl-1,5-dimethoxybenzene

1-{2,4-dimethoxy-5-[3-(3,4-dimethoxyphenyl)-2-propenoyl]phenyl}-3-(3,4-dimethoxyphenyl)-2-propen-1-one

Refernces

• 1、 Kumar Baba,Ashok,Rao, Boddu Ananda,Sarasija, Madderla,Murthy. "Microwave Assisted Synthesis and Biological Activity of Novel Bis{2-[2-(substituted benzylidene)hydrazinyl]thiazole} Derivatives". . p. 580 - 586. Retrieved 2018/04/24.
• 2、 Husain, Asif,Ahmad, Aftab,Mkhalid, Ibraheem Ahmed I.,Mishra, Ravinesh,Rashid, Mohd. "Synthesis and antimicrobial activity of bischalcone derivatives". . p. 1578 - 1586. Retrieved 2013/07/26.