Ethanone, 1-[2-[(3-methyl-2-butenyl)oxy]phenyl]-

Base Information

• Chemical Name: Ethanone, 1-[2-[(3-methyl-2-butenyl)oxy]phenyl]-
• CAS No.: 70538-46-4
• Molecular Formula: C13H16O2
• Molecular Weight: 204.269
• DSSTox Substance ID: DTXSID90462991
• Nikkaji Number: J1.192.913C
• Mol file: 70538-46-4.mol

Synonyms:Ethanone, 1-[2-[(3-methyl-2-butenyl)oxy]phenyl]-;70538-46-4;SCHEMBL3902349;DTXSID90462991;AKOS000202720

Chemical Property of Ethanone, 1-[2-[(3-methyl-2-butenyl)oxy]phenyl]-

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 204.115029749
• Heavy Atom Count: 15
• Complexity: 239

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCOC1=CC=CC=C1C(=O)C)C

Technology Process of Ethanone, 1-[2-[(3-methyl-2-butenyl)oxy]phenyl]-

There total 6 articles about Ethanone, 1-[2-[(3-methyl-2-butenyl)oxy]phenyl]- 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%

o-hydroxyacetophenone (118-93-4,104809-67-8) + prenyl bromide (870-63-3) → 1-(2-((3-methylbut-2-en-1-yl)oxy)phenyl)ethanone (70538-46-4)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 40 ℃; for 8h;

DOI:10.1016/j.ejmech.2005.10.020

Reference yield: 85.0%

o-hydroxyacetophenone (118-93-4,104809-67-8) + 3,3-dimethyl-allyl chloride (503-60-6) → 1-(2-((3-methylbut-2-en-1-yl)oxy)phenyl)ethanone (70538-46-4)

Guidance literature:

With potassium carbonate; In acetonitrile; at 25 ℃; for 20h; Reflux; Inert atmosphere;

DOI:10.1039/d1ob00058f

Reference yield: 85.0%

o-hydroxyacetophenone (118-93-4,104809-67-8) → 1-(2-((3-methylbut-2-en-1-yl)oxy)phenyl)ethanone (70538-46-4)

Guidance literature:

o-hydroxyacetophenone; With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 0.5h;

With prenyl bromide; In N,N-dimethyl-formamide; at 40 ℃; for 8h;

upstream raw materials:

o-hydroxyacetophenone

prenyl bromide

(E)-1-[2-(3-phenylprop-2-enyloxy)phenyl]ethanone

3,3-dimethyl-allyl chloride

Downstream raw materials:

o-hydroxyacetophenone

2-hydroxy-5-(3-methylbut-2-enyl)acetophenone

1-(2,2-dimethyl-chroman-8-yl)-ethanone

2-{1-[2-(3-Methylbut-2-enyloxy)phenyl]ethyliden}malononitril