2-(Furan-2-yl)benzaldehyde

Base Information

• Chemical Name: 2-(Furan-2-yl)benzaldehyde
• CAS No.: 16191-32-5
• Molecular Formula: C11H8O2
• Molecular Weight: 172.183
• Hs Code.: 2932190090
• DSSTox Substance ID: DTXSID40378210
• Nikkaji Number: J1.575.432J
• Wikidata: Q82167747
• ChEMBL ID: CHEMBL4531466
• Mol file: 16191-32-5.mol

Synonyms:2-(furan-2-yl)benzaldehyde;16191-32-5;2-Furan-2-yl-benzaldehyde;2-(2-furyl)benzaldehyde;2-(Fur-2-yl)benzaldehyde;2-(2-furanyl)benzaldehyde;2-Furylbenzaldehyde;SCHEMBL610633;2-FURAN-2-ylbenzALDEHYDE;CHEMBL4531466;DTXSID40378210;BJGHSPJMFHHOCJ-UHFFFAOYSA-N;MFCD03990475;STK001927;AKOS004113383;PS-5899;SB61248;2-Furan-2-yl-benzaldehyde, AldrichCPR;BB 0222420;FT-0637333;EN300-745681;A810306;F2167-0757

Chemical Property of 2-(Furan-2-yl)benzaldehyde

Chemical Property:

• Vapor Pressure: 0.00103mmHg at 25°C
• Refractive Index: 1.583
• Boiling Point: 301.8 °C at 760 mmHg
• Flash Point: 99.2 °C
• PSA: 30.21000
• Density: 1.154 g/cm³
• LogP: 2.75910
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 172.052429494
• Heavy Atom Count: 13
• Complexity: 179

Purity/Quality:

97% ^*data from raw suppliers

2-(2-Furyl)benzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C=O)C2=CC=CO2

Technology Process of 2-(Furan-2-yl)benzaldehyde

There total 7 articles about 2-(Furan-2-yl)benzaldehyde 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: 96.0%

fur-2-ylboronic acid (13331-23-2) + ortho-bromobenzaldehyde (6630-33-7) → 2-(2-furanyl)-benzaldehyde (16191-32-5)

Guidance literature:

With bis-triphenylphosphine-palladium(II) chloride; potassium carbonate; In ethanol; water; toluene; at 100 ℃; Inert atmosphere;

DOI:10.1039/C7OB00637C

Reference yield: 78.0%

2-bromofuran (584-12-3) + 2-formylbenzene boronic acid (40138-16-7) → 2-(2-furanyl)-benzaldehyde (16191-32-5)

Guidance literature:

With bis-triphenylphosphine-palladium(II) chloride; sodium carbonate; In water; acetonitrile; at 150 ℃; for 0.116667h; Microwave irradiation;

DOI:10.1021/jm800338j

Reference yield: 77.0%

2-(tributylstannyl)furan (118486-94-5) + ortho-bromobenzaldehyde (6630-33-7) → 2-(2-furanyl)-benzaldehyde (16191-32-5)

Guidance literature:

With triphenylphosphine; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In toluene; at 110 ℃; for 3h; Inert atmosphere;

DOI:10.1002/chem.201403113

upstream raw materials:

furan

2-formylbenzene boronic acid

2-bromofuran

sodium carbonate

Downstream raw materials:

2-(2-furyl)benzoic acid methyl ester

methyl furimidate

2-furancarbonitrile

2-(α-furyl)benzyl alcohol