Ethyl 2-(phenoxymethyl)prop-2-enoate

Base Information

• Chemical Name: Ethyl 2-(phenoxymethyl)prop-2-enoate
• CAS No.: 62680-47-1
• Molecular Formula: C12H14O3
• Molecular Weight: 206.241
• DSSTox Substance ID: DTXSID40541942
• Nikkaji Number: J1.398.267H
• Wikidata: Q82418422
• Mol file: 62680-47-1.mol

Synonyms:Ethyl 2-(phenoxymethyl)prop-2-enoate;62680-47-1;Ethyl 2-Phenoxymethylacrylate;SCHEMBL6613605;DTXSID40541942;OCTNSVPQFFDELX-UHFFFAOYSA-N;AKOS013432320

Chemical Property of Ethyl 2-(phenoxymethyl)prop-2-enoate

Chemical Property:

• PSA: 35.53000
• LogP: 2.18470
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 206.094294304
• Heavy Atom Count: 15
• Complexity: 217

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C(=C)COC1=CC=CC=C1

Technology Process of Ethyl 2-(phenoxymethyl)prop-2-enoate

There total 4 articles about Ethyl 2-(phenoxymethyl)prop-2-enoate 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: 97.0%

3-Bromo-2-bromomethyl-propionic acid ethyl ester (58539-11-0) + phenol (108-95-2,27073-41-2) → ethyl 2-(phenoxymethyl)acrylate (62680-47-1)

Guidance literature:

With sodium hydroxide; In ethanol; for 6h; Ambient temperature;

DOI:10.1016/S0040-4020(01)96670-0

Reference yield: 80.0%

phenol (108-95-2,27073-41-2) + ethyl 2-bromomethyl-2-propenoate (17435-72-2) → ethyl 2-(phenoxymethyl)acrylate (62680-47-1)

Guidance literature:

With potassium carbonate; In tetrahydrofuran; DMF (N,N-dimethyl-formamide); at 0 - 20 ℃; for 3h;

Reference yield: 79.0%

ethyl 2-(acetoxymethyl)acrylate (80787-04-8) + phenol (108-95-2,27073-41-2) → ethyl 2-(phenoxymethyl)acrylate (62680-47-1)

Guidance literature:

With aluminum oxide; potassium fluoride; triphenylphosphine; tris(dibenzylideneacetone)dipalladium⁽⁰⁾ chloroform complex; In tetrahydrofuran; at 20 ℃; for 4.5h;

DOI:10.1016/S0040-4020(00)00727-4

upstream raw materials:

3-Bromo-2-bromomethyl-propionic acid ethyl ester

phenol

ethyl 2-(acetoxymethyl)acrylate

ethyl 2-(hydroxymethyl)acrylate

Downstream raw materials:

3-benzyloxycarbonyl-3-methylchroman-4-one

3-methyl-chroman-4-one

ethyl 2-methyl-3-phenoxypropanoate

3-methylcoumarine