1-(2,6-Diethoxyphenyl)ethanone

Base Information

• Chemical Name: 1-(2,6-Diethoxyphenyl)ethanone
• CAS No.: 33675-61-5
• Molecular Formula: C12H16 O3
• Molecular Weight: 208.25
• DSSTox Substance ID: DTXSID70392000
• Wikidata: Q82189865
• Mol file: 33675-61-5.mol

Synonyms:1-(2,6-diethoxyphenyl)ethanone;33675-61-5;2',6'-Diethoxyacetophenone;1-(2,6-diethoxyphenyl)ethan-1-one;2' 6'-DIETHOXYACETOPHENONE 98;Ethanone, 1-(2,6-diethoxyphenyl)-;starbld0006483;SCHEMBL5088087;DTXSID70392000;JSHQXPUUAGGTDX-UHFFFAOYSA-N;2',6'-Diethoxyacetophenone, 98%;1-(2,6-diethoxyphenyl)-1-ethanone;STK661725;2 inverted exclamation marka,6 inverted exclamation marka-Diethoxyacetophenone;AKOS000299287;J-019292

Chemical Property of 1-(2,6-Diethoxyphenyl)ethanone

Chemical Property:

• Melting Point: 80-84 °C(lit.)
• Boiling Point: 308.0±22.0 °C(Predicted)
• PSA: 35.53000
• Density: 1.031±0.06 g/cm3(Predicted)
• LogP: 2.68660
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 208.109944368
• Heavy Atom Count: 15
• Complexity: 189

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCOC1=C(C(=CC=C1)OCC)C(=O)C

Technology Process of 1-(2,6-Diethoxyphenyl)ethanone

There total 1 articles about 1-(2,6-Diethoxyphenyl)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: 85.0%

ethyl bromide (74-96-4) + 2,6-dihydroxylacetophenone (699-83-2) → 2’,6’-diethoxyacetophenone (33675-61-5)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 60 ℃; for 16h; Inert atmosphere;

DOI:10.1021/acs.orglett.6b03761

Reference yield: 97.0%

2’,6’-diethoxyacetophenone (33675-61-5) → C12H18O3

Guidance literature:

With C₆₃H₈₇Br₂N₂P₂Ru; potassium tert-butylate; hydrogen; In isopropyl alcohol; at 40 ℃; for 36h; under 7600.51 Torr; Reagent/catalyst; enantioselective reaction;

DOI:10.1002/cctc.201800848

Reference yield: 67.0%

2’,6’-diethoxyacetophenone (33675-61-5) + 2,6-dimethoxybenzaldehyde (3392-97-0) → C21H24O5

Guidance literature:

With potassium hydroxide; In methanol; at 70 ℃;

DOI:10.1021/jm0708331

upstream raw materials:

ethyl bromide

2,6-dihydroxylacetophenone

Downstream raw materials:

(E)-2',6'-diethoxy-2,4,6-trimethoxychalcone

2',6'-diethoxy-2,4,6-trimethoxychalcone

2',6'-diethoxy-2,6-dimethoxychalcone

Refernces