4-Methyl-2-phenyl-7-(propan-2-yl)-1-benzofuran

Base Information

• Chemical Name: 4-Methyl-2-phenyl-7-(propan-2-yl)-1-benzofuran
• CAS No.: 88631-80-5
• Molecular Formula: C₁₈H₁₈O
• Molecular Weight: 250.34
• DSSTox Substance ID: DTXSID50517173
• Wikidata: Q82379014
• Mol file: 88631-80-5.mol

Synonyms:88631-80-5;7-Isopropyl-4-methyl-2-phenylbenzofuran;4-Methyl-2-phenyl-7-(propan-2-yl)-1-benzofuran;DTXSID50517173

Chemical Property of 4-Methyl-2-phenyl-7-(propan-2-yl)-1-benzofuran

Chemical Property:

• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 250.135765193
• Heavy Atom Count: 19
• Complexity: 292

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2C=C(OC2=C(C=C1)C(C)C)C3=CC=CC=C3

Technology Process of 4-Methyl-2-phenyl-7-(propan-2-yl)-1-benzofuran

There total 2 articles about 4-Methyl-2-phenyl-7-(propan-2-yl)-1-benzofuran 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:

2-Isopropyl-5-methyl-phenolphenacylether (39489-59-3) → 7-Isopropyl-4-methyl-2-phenyl-cumaron (88631-80-5)

Guidance literature:

With polyphosphoric acid (84percent P₄O₁₀); at 130 ℃; for 16h;

DOI:10.1515/znb-1983-1014

Reference yield:

thymol (89-83-8) → 7-Isopropyl-4-methyl-2-phenyl-cumaron (88631-80-5)

Guidance literature:

Multi-step reaction with 2 steps

1: 235 g / K₂CO₃ / acetone / 20 h / Heating

2: 82 g / polyphosphoric acid (84percent P₄O₁₀) / 16 h / 130 °C

With polyphosphoric acid (84percent P₄O₁₀); potassium carbonate; In acetone;

DOI:10.1515/znb-1983-1014

Reference yield:

7-Isopropyl-4-methyl-2-phenyl-cumaron (88631-80-5) → 2-Benzoxy-3-isopropyl-6-methylbenzaldehyd (344864-27-3)

Guidance literature:

With ozone; In water; acetic acid; at 15 ℃; for 16h;

DOI:10.1515/znb-1983-1014

upstream raw materials:

2-Isopropyl-5-methyl-phenolphenacylether

thymol

Downstream raw materials:

2-Benzoxy-3-isopropyl-6-methylbenzaldehyd

2-hydroxyl-3-isopropyl-6-methylbenzaldehyde

3-isopropyl-6-methyl-1,2-benzenediol