1-(2-Hydroxy-4,6-dimethoxyphenyl)-2-phenylethanone

Base Information

• Chemical Name: 1-(2-Hydroxy-4,6-dimethoxyphenyl)-2-phenylethanone
• CAS No.: 39604-66-5
• Molecular Formula: C16H16 O4
• Molecular Weight: 272.301
• Hs Code.: 2914509090
• European Community (EC) Number: 622-210-7
• DSSTox Substance ID: DTXSID90351018
• Nikkaji Number: J2.602.915E
• Wikidata: Q82127111
• Mol file: 39604-66-5.mol

Synonyms:39604-66-5;1-(2-hydroxy-4,6-dimethoxyphenyl)-2-phenylethanone;1-(2-hydroxy-4,6-dimethoxyphenyl)-2-phenylethan-1-one;2'-Hydroxy-4',6'-dimethoxy-2-phenylacetophenone;4',6'-Dimethoxy-2-2'-hydroxy-2-phenylacetophenone;DTXSID90351018;MFCD00218596;AKOS015912452;4'6'-Dimethoxy-2'-hydroxy-2-phenylacet&;Benzyl 2-Hydroxy-4,6-dimethoxyphenyl Ketone;CS-0332448;H1577;1-(2-hydroxy-4,6-dimethoxyphenyl)-2-phenyl-;T72423;4',6'-Dimethoxy-2-2'-hydroxy-2-phenylacetophenone, 96%

Chemical Property of 1-(2-Hydroxy-4,6-dimethoxyphenyl)-2-phenylethanone

Chemical Property:

• Vapor Pressure: 3.9E-09mmHg at 25°C
• Melting Point: 114-118oC(lit.)
• Boiling Point: 461.4°C at 760 mmHg
• Flash Point: 171.8°C
• PSA: 55.76000
• Density: 1.193g/cm³
• LogP: 2.83480
• Solubility.: soluble in Toluene
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 272.10485899
• Heavy Atom Count: 20
• Complexity: 312

Purity/Quality:

99.90% ^*data from raw suppliers

1-(2-Hydroxy-4,6-dimethoxyphenyl)-2-phenylethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,N
• Hazard Codes: Xi,N
• Statements: 41-50/53
• Safety Statements: 28-36/39-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C(=C1)OC)C(=O)CC2=CC=CC=C2)O

Technology Process of 1-(2-Hydroxy-4,6-dimethoxyphenyl)-2-phenylethanone

There total 6 articles about 1-(2-Hydroxy-4,6-dimethoxyphenyl)-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:

4,6-Dihydroxy-2-phenyl-cumaran-3-on (28750-78-9) → 2-hydroxy-4,6-dimethoxyphenyl benzyl ketone (39604-66-5)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂ / Pd-C / ethanol

2: K₂CO₃ / acetone / Heating

With hydrogen; potassium carbonate; palladium on activated charcoal; In ethanol; acetone;

Reference yield:

2-phenyl-2',4',6'-trihydroxyacetophenone (727-71-9) + dimethyl sulfate (77-78-1) → 2-hydroxy-4,6-dimethoxyphenyl benzyl ketone (39604-66-5)

Guidance literature:

With potassium carbonate; acetone;

Reference yield:

1,2,3-trimethoxybenzene (621-23-8) + phenylacetyl chloride (103-80-0) → 2-hydroxy-4,6-dimethoxyphenyl benzyl ketone (39604-66-5)

Guidance literature:

With aluminium trichloride; diethyl ether;

upstream raw materials:

ethanol

1-methyl-4-nitrosobenzene

5,7-dimethoxyisoflavone

3,5-dimethoxyphenol

Downstream raw materials:

furan-2-carboxylic acid-(4,6-dimethoxy-α-oxo-bibenzyl-2-yl ester)

5,7-dimethoxy-2-methyl-3-phenyl-chromen-4-one

3,6-dihydroxy-2,4-dimethoxy-deoxybenzoin

4-hydroxy-5,7-dimethoxy-3-phenylcoumarin