1-(3-Methoxyphenyl)pyrrolidine

Base Information

• Chemical Name: 1-(3-Methoxyphenyl)pyrrolidine
• CAS No.: 32040-07-6
• Molecular Formula: C11H15 N O
• Molecular Weight: 177.246
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20459016
• Nikkaji Number: J1.135.659A
• Wikidata: Q82282608
• ChEMBL ID: CHEMBL4463382
• Mol file: 32040-07-6.mol

Synonyms:1-(3-methoxyphenyl)pyrrolidine;32040-07-6;1-(3-METHOXY-PHENYL)-PYRROLIDINE;1-(3-Methoxyphenyl)-Pyrrolidine;SCHEMBL3051915;CHEMBL4463382;DTXSID20459016;SDWQEPLBCOZBFL-UHFFFAOYSA-N;Pyrrolidine, 1-(3-methoxyphenyl)-;AKOS006283675;FT-0736736;A18627

Chemical Property of 1-(3-Methoxyphenyl)pyrrolidine

Chemical Property:

• Boiling Point: 174 °C(Press: 20 Torr)
• PKA: 5.68±0.20(Predicted)
• PSA: 12.47000
• Density: 1.055±0.06 g/cm3(Predicted)
• LogP: 2.36040
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 177.115364102
• Heavy Atom Count: 13
• Complexity: 154

Purity/Quality:

97% ^*data from raw suppliers

1-(3-METHOXY-PHENYL)-PYRROLIDINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)N2CCCC2

Technology Process of 1-(3-Methoxyphenyl)pyrrolidine

There total 20 articles about 1-(3-Methoxyphenyl)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%

pyrrolidine (123-75-1) + 1-chloro-3-methoxy-benzene (2845-89-8) → 1-(3-methoxyphenyl)pyrrolidine (32040-07-6)

Guidance literature:

With [Pd(2-aminobiphenyl)(PCyp₂Ar^Xyl₂)](OMs); sodium t-butanolate; In tetrahydrofuran; at 80 ℃; for 19h; Reagent/catalyst; Inert atmosphere; Schlenk technique;

DOI:10.1002/chem.201903279

Reference yield: 99.0%

pyrrolidine (123-75-1) + 3-methoxyphenyl bromide (2398-37-0) → 1-(3-methoxyphenyl)pyrrolidine (32040-07-6)

Guidance literature:

With copper(l) iodide; potassium carbonate; L-proline; In dimethyl sulfoxide; at 90 ℃; for 31h;

DOI:10.1021/jo0504464

Reference yield: 97.0%

pyrrolidine (123-75-1) + 3-methoxy-2-(trimethylsilyl)phenyl-trifluoromethanesulfonate (217813-03-1) → 1-(3-methoxyphenyl)pyrrolidine (32040-07-6)

Guidance literature:

With cesium fluoride; In acetonitrile; at 20 ℃; for 5h;

DOI:10.1021/jo0602221

upstream raw materials:

1,4-dibromo-butane

m-Anisidine

cis,trans-2,5-dimethoxytetrahydrofuran

pyrrolidine

Downstream raw materials:

2-methoxy-6-(pyrrolidin-1-yl)benzaldehyde

2-methoxy-4-(1-pyrrolidinyl)benzaldehyde

2-(2-hydroxy-4-pyrrolidinophenyl)carbonylbenzoic acid