1-[3-[(tetrahydro-2H-pyran-2-yl)oxy]phenyl]Ethanone

Base Information

• Chemical Name: 1-[3-[(tetrahydro-2H-pyran-2-yl)oxy]phenyl]Ethanone
• CAS No.: 16162-70-2
• Molecular Formula: C13H16O3
• Molecular Weight: 220.268
• DSSTox Substance ID: DTXSID001224780
• Mol file: 16162-70-2.mol

Synonyms:1-[3-[(tetrahydro-2H-pyran-2-yl)oxy]phenyl]Ethanone;16162-70-2;SCHEMBL3058714;DTXSID001224780;FT-0726930;1-[3-(Tetrahydropyran-2-yloxy)phenyl]-ethanone

Chemical Property of 1-[3-[(tetrahydro-2H-pyran-2-yl)oxy]phenyl]Ethanone

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 220.109944368
• Heavy Atom Count: 16
• Complexity: 239

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)C1=CC(=CC=C1)OC2CCCCO2

Technology Process of 1-[3-[(tetrahydro-2H-pyran-2-yl)oxy]phenyl]Ethanone

There total 2 articles about 1-[3-[(tetrahydro-2H-pyran-2-yl)oxy]phenyl]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: 74.0%

3-(tetrahydro-2H-2-pyranyloxy)benzaldehyde (34716-73-9) + methylmagnesium bromide (75-16-1) → 1-(3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)ethan-1-one (16162-70-2)

Guidance literature:

3-(tetrahydro-2H-2-pyranyloxy)benzaldehyde; methylmagnesium bromide; In tetrahydrofuran; at 0 ℃; Green chemistry;

With [bis(acetoxy)iodo]benzene; at 0 - 20 ℃; Green chemistry;

DOI:10.1039/c4ra01748j

Reference yield:

3,4-dihydro-2H-pyran (110-87-2) + 3-Hydroxyacetophenone (121-71-1) → 1-(3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)ethan-1-one (16162-70-2)

Guidance literature:

With pyridinium p-toluenesulfonate; In dichloromethane; at 20 ℃;

Reference yield: 90.0%

1-(3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)ethan-1-one (16162-70-2) → 3-Hydroxyacetophenone (121-71-1)

Guidance literature:

With tin(IV) chloride; In dichloromethane; at 0 ℃; for 0.0333333h;

DOI:10.1016/j.tetlet.2014.05.009

upstream raw materials:

3,4-dihydro-2H-pyran

3-Hydroxyacetophenone

3-(tetrahydro-2H-2-pyranyloxy)benzaldehyde

methylmagnesium bromide

Downstream raw materials:

(E)-1-(3-hydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one

3-Hydroxyacetophenone

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