3-(3,5-Difluoro-4-methoxyphenyl)propionic acid

Base Information

• Chemical Name: 3-(3,5-Difluoro-4-methoxyphenyl)propionic acid
• CAS No.: 105219-44-1
• Molecular Formula: C₁₀H₁₀F₂O₃
• Molecular Weight: 216.184
• Hs Code.: 2918999090
• DSSTox Substance ID: DTXSID201263651
• Mol file: 105219-44-1.mol

Synonyms:3-(3,5-DIFLUORO-4-METHOXYPHENYL)PROPIONIC ACID;105219-44-1;3-(3,5-difluoro-4-methoxyphenyl)propanoic acid;SCHEMBL10480367;WOUCCZYVNXELFX-UHFFFAOYSA-N;DTXSID201263651;MFCD09832373;AKOS015956871;JS-4777;3,5-Difluoro-4-methoxybenzenepropanoic acid;CS-0325356;3-(3,5-DIFLUORO-4-METHOXYPHENYL)PROPIONICACID

Chemical Property of 3-(3,5-Difluoro-4-methoxyphenyl)propionic acid

Chemical Property:

• Melting Point: 83-86℃
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 216.05980050
• Heavy Atom Count: 15
• Complexity: 211

Purity/Quality:

99% ^*data from raw suppliers

3-(3,5-Difluoro-4-methoxyphenyl)propionic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1F)CCC(=O)O)F

Technology Process of 3-(3,5-Difluoro-4-methoxyphenyl)propionic acid

There total 2 articles about 3-(3,5-Difluoro-4-methoxyphenyl)propionic acid 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%

3-(3,5-difluoro-4-methoxyphenyl)propenoic acid + palladium (7440-05-3) → 3-(3,5-Difluoro-4-methoxyphenyl)propanoic acid (105219-44-1)

Guidance literature:

In tetrahydrofuran; pyrographite; ethyl acetate;

Reference yield:

3-(3,5-difluoro-4-methoxyphenyl)propenoic acid → 3-(3,5-Difluoro-4-methoxyphenyl)propanoic acid (105219-44-1)

Guidance literature:

palladium; In tetrahydrofuran; ethyl acetate;

Reference yield: 100.0%

3-(3,5-Difluoro-4-methoxyphenyl)propanoic acid (105219-44-1) → 3-(3,5-difluoro-4-methoxyphenyl)propan-1-ol (105219-45-2)

Guidance literature:

With borane; In tetrahydrofuran; methanol;

upstream raw materials:

palladium

Downstream raw materials:

3-(3,5-difluoro-4-methoxyphenyl)propan-1-ol

Refernces

• 1、 -. "Dopamine-β-hydroxylase inhibitors and use thereof". . . Retrieved 2008/06/13.