1-(3-(3-Methoxyphenoxy)-3-phenylpropyl)pyrrolidine

Base Information

• Chemical Name: 1-(3-(3-Methoxyphenoxy)-3-phenylpropyl)pyrrolidine
• CAS No.: 157846-77-0
• Molecular Formula: C₂₀H₂₅NO₂
• Molecular Weight: 311.424
• DSSTox Substance ID: DTXSID80935821
• Mol file: 157846-77-0.mol

Synonyms:1-(3-(3-Methoxyphenoxy)-3-phenylpropyl)pyrrolidine;Pyrrolidine, 1-(3-(3-methoxyphenoxy)-3-phenylpropyl)-;157846-77-0;1-[3-(3-methoxyphenoxy)-3-phenylpropyl]pyrrolidine;DTXSID80935821;LS-137977

Chemical Property of 1-(3-(3-Methoxyphenoxy)-3-phenylpropyl)pyrrolidine

Chemical Property:

• Vapor Pressure: 2.29E-08mmHg at 25°C
• Boiling Point: 452.2°Cat760mmHg
• Flash Point: 151°C
• Density: 1.082g/cm³
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 311.188529040
• Heavy Atom Count: 23
• Complexity: 324

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=CC=C1)OC(CCN2CCCC2)C3=CC=CC=C3

Technology Process of 1-(3-(3-Methoxyphenoxy)-3-phenylpropyl)pyrrolidine

There total 4 articles about 1-(3-(3-Methoxyphenoxy)-3-phenylpropyl)pyrrolidine 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:

1-phenyl-3-(pyrrolidin-1-yl)propan-1-ol (4641-67-2) → 1-[3-(3-Methoxy-phenoxy)-3-phenyl-propyl]-pyrrolidine (157846-77-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 58 percent / K₂CO₃ / acetone / 24 h / 0 - 4 °C

2: 1.) NaOH / 1.) aq. EtOH, 32 deg C, 10 min, 2.) aq. EtOH, 32 deg C, 48 h

With sodium hydroxide; potassium carbonate; In acetone;

Reference yield:

1-phenyl-3-(pyrrolidin-1-yl)propan-1-one (94-39-3) → 1-[3-(3-Methoxy-phenoxy)-3-phenyl-propyl]-pyrrolidine (157846-77-0)

Guidance literature:

Multi-step reaction with 3 steps

1: 75 percent / NaBH₄ / methanol

2: 58 percent / K₂CO₃ / acetone / 24 h / 0 - 4 °C

3: 1.) NaOH / 1.) aq. EtOH, 32 deg C, 10 min, 2.) aq. EtOH, 32 deg C, 48 h

With sodium hydroxide; sodium tetrahydroborate; potassium carbonate; In methanol; acetone;

Reference yield:

acetophenone (98-86-2) → 1-[3-(3-Methoxy-phenoxy)-3-phenyl-propyl]-pyrrolidine (157846-77-0)

Guidance literature:

Multi-step reaction with 4 steps

1: 60 percent / conc. HCl / ethanol / 6 h / Heating

2: 75 percent / NaBH₄ / methanol

3: 58 percent / K₂CO₃ / acetone / 24 h / 0 - 4 °C

4: 1.) NaOH / 1.) aq. EtOH, 32 deg C, 10 min, 2.) aq. EtOH, 32 deg C, 48 h

With hydrogenchloride; sodium hydroxide; sodium tetrahydroborate; potassium carbonate; In methanol; ethanol; acetone;

upstream raw materials:

O-methylresorcine

Methanesulfonic acid 1-phenyl-3-pyrrolidin-1-yl-propyl ester

1-phenyl-3-(pyrrolidin-1-yl)propan-1-ol

1-phenyl-3-(pyrrolidin-1-yl)propan-1-one

Refernces