2-Isopropylbenzofuran

Base Information

• Chemical Name: 2-Isopropylbenzofuran
• CAS No.: 28748-41-6
• Molecular Formula: C11H12 O
• Molecular Weight: 160.216
• Hs Code.: 2932999099
• DSSTox Substance ID: DTXSID80447979
• Nikkaji Number: J2.920.023H
• Wikidata: Q82266885
• Mol file: 28748-41-6.mol

Synonyms:2-isopropylbenzofuran;28748-41-6;2-propan-2-yl-1-benzofuran;Benzofuran, 2-(1-methylethyl)-;2-isopropyl-benzofuran;2-Isopropyl-1-benzo[b]furan;SCHEMBL162882;2-(propan-2-yl)-1-benzofuran;DTXSID80447979;AKOS015841765;AT34638;FT-0757298

Chemical Property of 2-Isopropylbenzofuran

Chemical Property:

• Vapor Pressure: 0.205mmHg at 25°C
• Refractive Index: 1.56
• Boiling Point: 216.468°C at 760 mmHg
• Flash Point: 79.62°C
• PSA: 13.14000
• Density: 1.024g/cm³
• LogP: 3.55620
• Storage Temp.: 2-8°C
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 160.088815002
• Heavy Atom Count: 12
• Complexity: 153

Purity/Quality:

99% ^*data from raw suppliers

2-Isopropylbenzofuran 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CC2=CC=CC=C2O1

Technology Process of 2-Isopropylbenzofuran

There total 32 articles about 2-Isopropylbenzofuran 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: 90.0%

2-isopropenyl-2,3-dihydrobenzofuran (62452-76-0) → 2-(1-methylethyl)benzofuran (28748-41-6)

Guidance literature:

With hydrogen bromide; In acetic acid; at 100 ℃; for 0.5h;

DOI:10.1016/S0040-4020(01)85988-3

Reference yield: 80.0%

(2-Isobutyryloxy-benzyl)-triphenyl-phosphonium; bromide → 2-(1-methylethyl)benzofuran (28748-41-6)

Guidance literature:

With triethylamine; In toluene; for 3h; Heating;

DOI:10.1016/S0040-4020(01)92357-9

Reference yield: 72.0%

phenylpropyne (104971-13-3) → 2-(1-methylethyl)benzofuran (28748-41-6)

Guidance literature:

With lithium iodide; In various solvent(s); for 18h; Heating;

DOI:10.1039/P19850002443

upstream raw materials:

2-(α-methylvinyl)benzofuran

2-isopropenyl-2,3-dihydrobenzofuran

phenylpropyne

ethyl 2-bromoisovalerate

Downstream raw materials:

(-)-2-isopropyl-2,3-dihydrobenzofuran

(S)-2-isopropyl-2,3-dihydrobenzofuran

2-isopropyl-2,3-dihydrobenzofuran