39604-68-7

Basic information

• Product Name: 1-(2-Hydroxy-4,6-dimethoxyphenyl)-2-(4-methoxyphenyl)ethanone
• Synonyms: 2'-Hydroxy-4',6'-dimethoxy-2-(4-methoxyphenyl)acetophenone
• CAS NO: 39604-68-7
• Molecular Formula: C₁₇H₁₈O₅
• Molecular Weight: 302.32
• Mol File: 39604-68-7.mol
• Article Data: 5

Chemical Properties

• Melting Point: 85.0 to 89.0 °C
• Boiling Point: 494.8±40.0 °C(Predicted)
• Appearance: /
• Density: 1.199±0.06 g/cm3(Predicted)
• Solubility: soluble in Toluene
• PKA: 7.07±0.40(Predicted)
• CAS DataBase Reference: 1-(2-Hydroxy-4,6-dimethoxyphenyl)-2-(4-methoxyphenyl)ethanone(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(2-Hydroxy-4,6-dimethoxyphenyl)-2-(4-methoxyphenyl)ethanone(39604-68-7)
• EPA Substance Registry System: 1-(2-Hydroxy-4,6-dimethoxyphenyl)-2-(4-methoxyphenyl)ethanone(39604-68-7)

Safety Data

• Hazardous Substances Data: 39604-68-7(Hazardous Substances Data)

Usage

Preparation

Preparation by partial methylation of 2,4,6-tri-hydroxyphenyl 4-methoxybenzyl ketone, ? with dimethyl sulfate in the presence of potassium carbonate in refluxing acetone, for 3 h (64%); ? with diazomethane in ethyl ether at 0° (80%) or in methanol; ? with methyl iodide in the presence of potassium carbonate in refluxing acetone for 3 h (42%).

Upstream product

• 500-99-2 3,5-dimethoxyphenol 
• 104-47-2 p-methoxybenzylnitrile 
• 15485-66-2 2,4,6-trihydroxy-4'-methoxydeoxybenzoin 
• 77-78-1 dimethyl sulfate 
• 74-88-4 methyl iodide 
• 50-00-0 formaldehyd 
• 39604-66-5 2-hydroxy-4,6-dimethoxyphenyl benzyl ketone 
• 64818-77-5 (+/-)-3-hydroxy-4,6-dimethoxy-3-(p-methoxybenzyl)benzofuran-2(3H)-one 
• 15485-65-1 2,4,4',6-tetrahydroxydeoxybenzoin 
• 186581-53-3 diazomethane 
• 104-01-8 4-Methoxyphenylacetic acid 
• 621-23-8 1,2,3-trimethoxybenzene 
• 108-73-6 3,5-dihydroxyphenol 
• 117828-32-7 4,6-dihydroxy-2-(4-methoxyphenyl)benzofuran-3(2H)-one 

Downstream Products

• 787637-49-4 2,4,6,4'-tetramethoxy-deoxybenzoin 
• 54321-18-5 5,7-dimethoxy-3-(4-methoxy-phenyl)-2-methyl-chromen-4-one 
• 102019-20-5 6,8-dimethoxy-4-(4-methoxy-phenyl)-3,4-dihydro-benz[b]oxepin-2,5-dione 
• 14736-59-5 4-hydroxy-5,7-dimethoxy-3-(4-methoxyphenyl)-1-benzopyran-2-one 
• 1162-82-9 4',5,7-trimethoxyisoflavone 
• 21554-70-1 4',5,7-trimethoxyisoflavanone 
• 96682-32-5 2-hydroxy-4,6-dimethoxyphenyl α-hydroxymethyl-4-methoxybenzyl ketone 
• 28750-74-5 1-(3-Bromo-2-hydroxy-4,6-dimethoxy-phenyl)-2-(4-methoxy-phenyl)-ethanone 
• 218899-18-4 Hexanedioic acid 3,5-dimethoxy-2-[2-(4-methoxy-phenyl)-acetyl]-phenyl ester ethyl ester 
• 218899-20-8 Hexanedioic acid 3,5-dimethoxy-2-[2-(4-methoxy-phenyl)-acetyl]-phenyl ester methyl ester 
• 218899-23-1 Nonanedioic acid 3,5-dimethoxy-2-[2-(4-methoxy-phenyl)-acetyl]-phenyl ester methyl ester 
• 218899-27-5 Decanedioic acid 3,5-dimethoxy-2-[2-(4-methoxy-phenyl)-acetyl]-phenyl ester methyl ester 
• 218899-26-4 Nonanedioic acid butyl ester 3,5-dimethoxy-2-[2-(4-methoxy-phenyl)-acetyl]-phenyl ester 
• 218899-30-0 Decanedioic acid butyl ester 3,5-dimethoxy-2-[2-(4-methoxy-phenyl)-acetyl]-phenyl ester 

Relevant articles and documents

Synthesis, crystal structure and antimicrobial activity of deoxybenzoin derivatives from genistein

A series of deoxybenzoin derivatives from genistein were synthesized and their structures were elucidated by 1H NMR, mass spectral data and micro analyses. The structures of 2, 7 and 10 were determined by single-crystal X-ray analysis. These obtained compounds were evaluated for their assayed antibacterial (Bacillus subtilis, Escherichia coli, Pseudomonas fluorescence and Staphylococcus aureus) and antifungal (Aspergillus niger, Candida albicans and Trichophyton rubrum) activities by MTT (3-(4,5-dimethylthiazol-2-yl)-2,5-diphenyl tetrazolium bromide) method. Most compounds have displayed comparable antibacterial activity against bacterial. On the basis of the biological results, structure-activity relationships are discussed.

A facile synthesis of 2-substituted isoflavones for immunoassay: Assembly of the isoflavonoid skeleton by means of a novel cyclisation reaction

For the purpose of the development of immunoassays for wide-scale screening, isoflavones suitable for attachment to a hapten were prepared. A new cyclisation reaction allowed the direct conversion of 2- (acyloxy)deoxybenzoins to 2-alkylisoflavones by treatment with chlorotrimethylsilane and triethylamine in dimethylformamide.

A Novel Photochemical Structural Inversion: The First Methoxy-Hydroxymethyl Isomerization

Photolysis of 4-methoxybenzofuran-3(2H)-ones provides the first example of structural inversion of an arylmethoxy-group to the corresponding hydroxymethyl function.Suitable structural parameters permit subsequent rearrangement of the heterocyclic ring to 5-hydroxyisochroman-4-ones.By contrast photolysis of the isomeric 4-methoxybenzofuran-2(3H)-one leads directly to the deoxybenzoin analogue.