3-(6-Methoxy-3-methyl-2-benzofuran-1-yl)propanoic acid

Base Information

• Chemical Name: 3-(6-Methoxy-3-methyl-2-benzofuran-1-yl)propanoic acid
• CAS No.: 10410-30-7
• Molecular Formula: C₁₃H₁₄O₄
• Molecular Weight: 234.252
• Hs Code.: 2932999099
• DSSTox Substance ID: DTXSID10698856
• Wikidata: Q82629378
• Mol file: 10410-30-7.mol

Synonyms:10410-30-7;3-(6-Methoxy-3-methyl-2-benzofuran-1-yl)propanoic acid;DTXSID10698856;UXYXOHOEBPLIJJ-UHFFFAOYSA-N

Chemical Property of 3-(6-Methoxy-3-methyl-2-benzofuran-1-yl)propanoic acid

Chemical Property:

• PSA: 59.67000
• LogP: 2.76700
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 234.08920892
• Heavy Atom Count: 17
• Complexity: 279

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2C=CC(=CC2=C(O1)CCC(=O)O)OC

Technology Process of 3-(6-Methoxy-3-methyl-2-benzofuran-1-yl)propanoic acid

There total 4 articles about 3-(6-Methoxy-3-methyl-2-benzofuran-1-yl)propanoic 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:

(6-methoxy-3-methyl-benzofuran-2-yl)-acetic acid (860184-13-0) → β-<6-Methoxy-3-methyl-2-benzofuryl>-propionsaeure (10410-30-7)

Guidance literature:

With thionyl chloride; Behandeln des Reaktionsprodukts mit Diazomethan in Aether und Erwaermen mit Silberoxid in Dioxan und einer wss. Loesung von Natriumthiosulfat und Kaliumcarbonat_.;

DOI:10.1039/jr9590002203

Reference yield:

6-methoxy-3-methylbenzofuran (29040-52-6) + β-Propiolactone (57-57-8) → β-<6-Methoxy-3-methyl-2-benzofuryl>-propionsaeure (10410-30-7)

Guidance literature:

at 200 ℃;

DOI:10.1039/jr9590002203

Reference yield:

1-diazo-3-(6-methoxy-3-methyl-benzofuran-2-yl)-acetone + sodium thiosulfate → β-<6-Methoxy-3-methyl-2-benzofuryl>-propionsaeure (10410-30-7)

Guidance literature:

DOI:10.1039/jr9590002203

upstream raw materials:

6-methoxy-3-methylbenzofuran

β-Propiolactone

(6-methoxy-3-methyl-benzofuran-2-yl)-acetic acid