2-[(4-Methoxyphenyl)methyl]pyrrolidine

Base Information

• Chemical Name: 2-[(4-Methoxyphenyl)methyl]pyrrolidine
• CAS No.: 66162-38-7
• Molecular Formula: C12H17NO
• Molecular Weight: 191.273
• DSSTox Substance ID: DTXSID00407353
• Nikkaji Number: J1.724.455H
• Mol file: 66162-38-7.mol

Synonyms:2-[(4-methoxyphenyl)methyl]pyrrolidine;2-(4-methoxybenzyl)pyrrolidine;66162-38-7;Oprea1_500127;SCHEMBL3167638;2-(4-methoxybenzyl)-pyrrolidine;DTXSID00407353;QAMFOPPPDHATJR-UHFFFAOYSA-N;2-(4-Methoxy-benzyl)-pyrrolidine;AKOS000150353;AKOS016343530;AS-40253;BB 0249492;CS-0248543;EN300-40173;Z285198380

Chemical Property of 2-[(4-Methoxyphenyl)methyl]pyrrolidine

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 191.131014166
• Heavy Atom Count: 14
• Complexity: 164

Purity/Quality:

95-99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)CC2CCCN2

Technology Process of 2-[(4-Methoxyphenyl)methyl]pyrrolidine

There total 10 articles about 2-[(4-Methoxyphenyl)methyl]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: 99.0%

5-(4-methoxy-benzyl)-pyrrolidin-2-one (26052-80-2) → 2-(4-methoxybenzyl)pyrrolidine (66162-38-7)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; 1.) 0.5, room temp., 2.) 4 h, reflux;

DOI:10.1248/cpb.30.180

Reference yield:

N-nitrosopyrrolidine (930-55-2) + p-Methoxybenzyl bromide (2746-25-0) → 2-(4-methoxybenzyl)pyrrolidine (66162-38-7)

Guidance literature:

With n-butyllithium; diisopropylamine; aluminum nickel; In tetrahydrofuran; methanol; hexane; dichloromethane; acetic acid;

Reference yield:

5-(4-methoxy-benzyl)-3,4-dihydro-2H-pyrrole (133111-44-1) → 2-(4-methoxybenzyl)pyrrolidine (66162-38-7)

Guidance literature:

With zinc chloride diethyl ether; sodium cyanoborohydride; In tetrahydrofuran; ethanol; at 25 ℃; for 20h;

DOI:10.1016/S0040-4039(02)00644-5

upstream raw materials:

5-(4-methoxy-benzyl)-pyrrolidin-2-one

5-(4-methoxy-benzyl)-3,4-dihydro-2H-pyrrole

5-(4-methoxyphenyl)pent-4-yn-1-amine

N-nitrosopyrrolidine

Downstream raw materials:

4-[2-(4-Methoxy-benzyl)-pyrrolidin-1-yl]-4-oxo-butyric acid methyl ester

4-[2-(4-Methoxy-benzyl)-pyrrolidin-1-yl]-butan-1-ol

3,4-Dimethoxy-benzoic acid 4-[2-(4-methoxy-benzyl)-pyrrolidin-1-yl]-butyl ester