2-(2-Phenylethyl)tetrahydrofuran

Base Information

• Chemical Name: 2-(2-Phenylethyl)tetrahydrofuran
• CAS No.: 2429-96-1
• Molecular Formula: C12H16 O
• Molecular Weight: 176.258
• NSC Number: 110591
• DSSTox Substance ID: DTXSID60296629
• Mol file: 2429-96-1.mol

Synonyms:2429-96-1;2-phenethyltetrahydrofuran;2-(2-phenylethyl)tetrahydrofuran;NSC110591;SCHEMBL11242354;DTXSID60296629;NSC-110591

Chemical Property of 2-(2-Phenylethyl)tetrahydrofuran

Chemical Property:

• Vapor Pressure: 0.0143mmHg at 25°C
• Boiling Point: 266.4°Cat760mmHg
• Flash Point: 110.7°C
• Density: 0.989g/cm³
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 176.120115130
• Heavy Atom Count: 13
• Complexity: 138

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(OC1)CCC2=CC=CC=C2

Technology Process of 2-(2-Phenylethyl)tetrahydrofuran

There total 10 articles about 2-(2-Phenylethyl)tetrahydrofuran 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: 70.0%

(R)-6-Phenyl-hexane-1,4-diol (2430-76-4,138298-27-8) → 2-(2-phenylethyl)tetrahydrofuran (2429-96-1)

Guidance literature:

With N-Bromosuccinimide; triphenylphosphine; In dichloromethane; for 48h; Ambient temperature;

DOI:10.1016/S0040-4020(01)81944-X

Reference yield: 59.0%

6-phenyl-hex-3-en-1-ol (64025-65-6) → 2-(2-phenylethyl)tetrahydrofuran (2429-96-1) + C12H18O2 (1040772-99-3)

Guidance literature:

6-phenyl-hex-3-en-1-ol; With trifluorormethanesulfonic acid; dimethyl sulfide borane; In dichloromethane; at -78 - -20 ℃;

With sodium hydroxide; dihydrogen peroxide; In methanol; dichloromethane; water; at -20 - 20 ℃;

DOI:10.1021/ja800402g

Reference yield: 44.0%

tetrahydrofuran (109-99-9,24979-97-3,77392-70-2) + phenethylmagnesium chloride (90878-19-6) → 2-(2-phenylethyl)tetrahydrofuran (2429-96-1)

Guidance literature:

With C₃₁H₃₈ClN₃NiO₂^(1-)*Li⁽¹⁺⁾; In ethylene dibromide; at 25 ℃; for 2h; Catalytic behavior; Inert atmosphere;

DOI:10.1007/s10562-013-1170-8

upstream raw materials:

Tetrahydrofurfuryl alcohol

2-(2-phenylethyl)furan

benzaldehyde

tetrahydro-2-furanylmethyl(triphenyl)phosphonium bromide