4-(5-(3-Hydroxypropyl)-7-methoxybenzofuran-2-yl)-2-methoxyphenol

Base Information

• Chemical Name: 4-(5-(3-Hydroxypropyl)-7-methoxybenzofuran-2-yl)-2-methoxyphenol
• CAS No.: 144735-57-9
• Molecular Formula: C19H20 O5
• Molecular Weight: 328.365
• Hs Code.: 2932999099
• DSSTox Substance ID: DTXSID90425107
• Nikkaji Number: J3.617.517F
• Wikidata: Q72484896
• Mol file: 144735-57-9.mol

Synonyms:144735-57-9;4-(5-(3-Hydroxypropyl)-7-methoxybenzofuran-2-yl)-2-methoxyphenol;4-[5-(3-hydroxypropyl)-7-methoxy-1-benzofuran-2-yl]-2-methoxyphenol;2-4-Hydroxy-3-methoxyphenyl-7-methoxy-5-benzofuranpropanol;ICCB1_000073;SCHEMBL18223919;DTXSID90425107;FEONDVSBLGLFAZ-UHFFFAOYSA-N;2-(4-Hydroxy-3-methoxyphenyl) -7-methoxy-5-benzofuranpropanol;AKOS015999054;J3.617.517F;3-[2-(3-Methoxy-4-hydroxyphenyl)-7-methoxybenzofuran-5-yl]-1-propanol;4-[5-(3-Hydroxypropyl)-7-methoxy-1-benzo[b]furan-2-yl]-2-methoxyphenol

Chemical Property of 4-(5-(3-Hydroxypropyl)-7-methoxybenzofuran-2-yl)-2-methoxyphenol

Chemical Property:

• PSA: 72.06000
• LogP: 3.74750
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 328.13107373
• Heavy Atom Count: 24
• Complexity: 390

Purity/Quality:

98%min ^*data from raw suppliers

2-4-Hydroxy-3-methoxyphenyl-7-methoxy-5-benzofuranpropanol ≥98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC(=CC2=C1OC(=C2)C3=CC(=C(C=C3)O)OC)CCCO

Technology Process of 4-(5-(3-Hydroxypropyl)-7-methoxybenzofuran-2-yl)-2-methoxyphenol

There total 21 articles about 4-(5-(3-Hydroxypropyl)-7-methoxybenzofuran-2-yl)-2-methoxyphenol 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: 88.0%

5-(3-hydroxypropyl)-7-methoxy-2-(3'-methoxy-4'-(benzyloxy)phenyl)benzofuran (135040-86-7) → 2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-7-methoxybenzofurane (144735-57-9)

Guidance literature:

With boron tribromide; In dichloromethane; at -78 - 20 ℃; Inert atmosphere;

DOI:10.5012/bkcs.2010.31.04.965

Reference yield: 86.1%

3-(2-(4-(tert-butyldimethylsiloxy)-3-methoxyphenyl)-7-methoxybenzofuran-5-yl)propane-1-ol → 2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-7-methoxybenzofurane (144735-57-9)

Guidance literature:

With tetrabutyl ammonium fluoride; In tetrahydrofuran; at 0 - 20 ℃; for 0.5h;

Reference yield: 82.0%

5-((2-methoxycarbonyl)ethyl)-7-methoxy-2-(3'-methoxy-4'-hydroxyphenyl)benzofuran (144735-56-8) → 2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-7-methoxybenzofurane (144735-57-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 4h; Ambient temperature;

DOI:10.1021/jo00052a046

upstream raw materials:

5-((2-methoxycarbonyl)ethyl)-7-methoxy-2-(3'-methoxy-4'-hydroxyphenyl)benzofuran

4-benzyloxy-3-methoxyacetophenone

vanillin

5-bromo-4-hydroxy-3-methoxybenzaldehyde

Downstream raw materials:

4-acetyl-5-(3-acetoxypropyl)-7-methoxy-2-(3'-methoxy-4'-acetoxyphenyl)benzofuran

5-(3-hydroxypropyl)-7-methoxy-2-(3'-methoxy-4'-hydroxyphenyl)benzofuran-4-carbaldehyde

5-(3-hydroxypropyl)-7-methoxy-3-methyl-2-(3'-methoxy-4'-hydroxyphenyl)benzofuran

5-(3-hydroxypropyl)-7-methoxy-2-(3'-methoxy-4'-hydroxyphenyl)-3-benzo[b]furan-carbaldehyde

Refernces

• 1、 -. "NOVEL 2-PHENYLBENZOFURAN DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PRODUCTION METHOD FOR SAME AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING INFLAMMATORY DISEASE COMPRISING SAME AS ACTIVE INGREDIENT". Paragraph 0196-0197. . Retrieved 2016/12/01.
• 2、 Yang, Zhen,Liu, Han Biao,Lee, Chi Ming,Chang, Hson Mou,Wong, Henry N. C.. "Regioselective Introduction of Carbon-3 Substituents to 5-Alkyl-7-methoxy-2-phenylbenzofurans: Synthesis of a Novel Adenosine A1 Receptor Ligand and Its Derivatives". . p. 7248 - 7257. Retrieved 2007/10/02.