Allyl (3-ethylphenyl) ether

Base Information

• Chemical Name: Allyl (3-ethylphenyl) ether
• CAS No.: 58621-53-7
• Molecular Formula: C₁₁H₁₄O
• Molecular Weight: 162.232
• DSSTox Substance ID: DTXSID601294030
• Nikkaji Number: J1.632.115J
• Mol file: 58621-53-7.mol

Synonyms:1-ethyl-3-(prop-2-en-1-yloxy)benzene;allyl (3-ethylphenyl) ether;allyl m-ethylphenyl ether;(3-Ethylphenyl)allyl ether;1-(allyloxy)-3-ethylbenzene;SCHEMBL20482022;DTXSID601294030;(3-ethylphenyl) (2-propenyl) ether;AKOS008950082;benzene, 1-ethyl-3-(2-propenyloxy)-;1-Ethyl-3-(2-propen-1-yloxy)benzene;58621-53-7

Chemical Property of Allyl (3-ethylphenyl) ether

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 162.104465066
• Heavy Atom Count: 12
• Complexity: 131

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC1=CC(=CC=C1)OCC=C

Technology Process of Allyl (3-ethylphenyl) ether

There total 3 articles about Allyl (3-ethylphenyl) ether 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: 71.0%

3-ethylphenol (620-17-7) + allyl bromide (106-95-6) → 1-(allyloxy)-3-ethylbenzene (58621-53-7)

Guidance literature:

With potassium carbonate; In acetone; Reflux;

DOI:10.1055/s-0040-1706683

Reference yield: 68.0%

3-ethylphenol (620-17-7) → 1-(allyloxy)-3-ethylbenzene (58621-53-7)

Guidance literature:

With potassium carbonate; In acetone;

DOI:10.1039/b101837j

Reference yield:

1-Ethyl-3-[((Z)-propenyl)oxy]-benzene → 1-(allyloxy)-3-ethylbenzene (58621-53-7)

Guidance literature:

With potassium tert-butylate; In dimethyl sulfoxide; at 100.05 ℃; Further Variations:; Temperatures; Equilibrium constant;

DOI:10.1039/b101837j

upstream raw materials:

3-ethylphenol

allyl bromide

Downstream raw materials:

3-ethylphenol