Ethyl 3-(4-methoxyphenyl)butanoate

Base Information

• Chemical Name: Ethyl 3-(4-methoxyphenyl)butanoate
• CAS No.: 61292-83-9
• Molecular Formula: C₁₃H₁₈O₃
• Molecular Weight: 222.284
• European Community (EC) Number: 827-047-7
• Nikkaji Number: J2.750.520A
• Mol file: 61292-83-9.mol

Synonyms:ethyl 3-(4-methoxyphenyl)butanoate;61292-83-9;starbld0029299;SCHEMBL12430380;ORAUFGIENZKKPP-UHFFFAOYSA-N;(-)-Ethyl 3-(4-methoxyphenyl)butanoate;EN300-6480992;Z1352286712

Chemical Property of Ethyl 3-(4-methoxyphenyl)butanoate

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 222.125594432
• Heavy Atom Count: 16
• Complexity: 207

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of Ethyl 3-(4-methoxyphenyl)butanoate

There total 10 articles about Ethyl 3-(4-methoxyphenyl)butanoate 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: 100.0%

(E)-ethyl 3-(4-methoxyphenyl)but-2-enoate (7706-82-3) → (+/-)-ethyl 3-(4-methoxyphenyl)butanoate (61292-83-9)

Guidance literature:

With 10% Pd/C; hydrogen; In methanol; under 1500.15 Torr; Inert atmosphere;

DOI:10.1002/chem.201200907

Reference yield: 91.0%

ethyl crotonate (10544-63-5) + 4-methoxyphenylboronic acid (5720-07-0) → (+/-)-ethyl 3-(4-methoxyphenyl)butanoate (61292-83-9)

Guidance literature:

With [Rh(OH)(cod)]2; surfactant TPGS-750-M; potassium carbonate; In water; at 20 ℃; for 0.5h; Green chemistry;

DOI:10.1016/j.tet.2015.07.016

Reference yield: 56.0%

ethanol (64-17-5) + 3-(4'-methoxyphenyl)butanoyl chloride (18310-76-4) → (+/-)-ethyl 3-(4-methoxyphenyl)butanoate (61292-83-9)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃;

DOI:10.1016/j.tetasy.2010.12.019

upstream raw materials:

3-(4-methoxyphenyl)-2-butenoic acid ethyl ester

(E)-ethyl 3-(4-methoxyphenyl)but-2-enoate

ethyl (E)-crotonate

1-(4-methoxyphenyl)ethanone

Downstream raw materials:

3-(4-methoxyphenyl)butyric acid

3-(4-methoxyphenyl)butan-1-ol

(R)-(-)-ethyl 3-(4-methoxyphenyl)butanoate

ethyl (S)-3-(4-methoxyphenyl)butanoate