(4-Hydroxyphenyl)(2-phenyl-1-benzofuran-3-yl)methanone

Base Information

• Chemical Name: (4-Hydroxyphenyl)(2-phenyl-1-benzofuran-3-yl)methanone
• CAS No.: 55877-36-6
• Molecular Formula: C21H14O3
• Molecular Weight: 314.33400
• ChEMBL ID: CHEMBL297162
• DSSTox Substance ID: DTXSID80533048
• Wikidata: Q82406102

Synonyms:55877-36-6;(4-Hydroxyphenyl)(2-phenyl-1-benzofuran-3-yl)methanone;(4-hydroxyphenyl)-(2-phenyl-1-benzofuran-3-yl)methanone;CHEMBL297162;SCHEMBL11672355;DTXSID80533048;RDWUDKIZLACHKY-UHFFFAOYSA-N;2-phenyl-3-(4-hydroxybenzoyl)benzofuran;3-(4-hydroxybenzoyl)-2-phenylbenzofuran

Chemical Property of (4-Hydroxyphenyl)(2-phenyl-1-benzofuran-3-yl)methanone

Chemical Property:

• PSA: 50.44000
• LogP: 5.03640
• XLogP3: 5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 314.094294304
• Heavy Atom Count: 24
• Complexity: 434

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=C(C3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)O

Technology Process of (4-Hydroxyphenyl)(2-phenyl-1-benzofuran-3-yl)methanone

There total 6 articles about (4-Hydroxyphenyl)(2-phenyl-1-benzofuran-3-yl)methanone 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: 75.0%

2-phenyl-3-(4'-methoxybenzoyl)benzofuran (55877-35-5) → 2-phenyl-3-(4'-hydroxybenzoyl)benzofuran (55877-36-6)

Guidance literature:

With pyridine hydrochloride; at 200 ℃; for 2h;

Reference yield:

1-(4-Hydroxyphenyl)-2-phenylethanone (2491-32-9) → 2-phenyl-3-(4'-hydroxybenzoyl)benzofuran (55877-36-6)

Guidance literature:

Multi-step reaction with 5 steps

1: 100 percent / HCl (gas) / ethyl acetate; ethanol / 1.) 0 deg C, 15 min, 2.) overnight

2: 75 percent / conc. H₂SO₄, 30 percent H₂O₂ / methanol / 0 °C

3: 80 percent / KOH / aq. ethanol / 10 h / Heating

4: 25 percent / aq. HCl, HOAc / 10 h / Heating

5: 75 percent / pyridine hydrochloride / 2 h / 200 °C

With hydrogenchloride; potassium hydroxide; sulfuric acid; dihydrogen peroxide; pyridine hydrochloride; acetic acid; In methanol; ethanol; ethyl acetate;

Reference yield:

2-(p-Hydroxy)phenyl-3-benzoylbenzofuran (57664-48-9) → 2-phenyl-3-(4'-hydroxybenzoyl)benzofuran (55877-36-6)

Guidance literature:

Multi-step reaction with 3 steps

1: 80 percent / KOH / aq. ethanol / 10 h / Heating

2: 25 percent / aq. HCl, HOAc / 10 h / Heating

3: 75 percent / pyridine hydrochloride / 2 h / 200 °C

With hydrogenchloride; potassium hydroxide; pyridine hydrochloride; acetic acid; In ethanol;

upstream raw materials:

2-phenyl-3-(4'-methoxybenzoyl)benzofuran

1-(4-Hydroxyphenyl)-2-phenylethanone

2-(p-Hydroxy)phenyl-3-benzoylbenzofuran

2-(p-Methoxy)phenyl-3-benzoylbenzofuran

Downstream raw materials:

3-[4-(3-di-n-propylaminopropoxy)benzoyl]-2-phenylbenzofuran

2-Phenyl-3-(p-pyrrolidinoethoxybenzoyl)benzofuran

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