2,5-Diethyl-1-propylpyrrole

Base Information

• Chemical Name: 2,5-Diethyl-1-propylpyrrole
• CAS No.: 123147-20-6
• Molecular Formula: C11H19N
• Molecular Weight: 165.278
• DSSTox Substance ID: DTXSID00704450
• Wikidata: Q82636879
• Mol file: 123147-20-6.mol

Synonyms:2,5-Diethyl-1-propylpyrrole;123147-20-6;2,5-Diethyl-1-propyl-1H-pyrrole;DTXSID00704450;FT-0735014

Chemical Property of 2,5-Diethyl-1-propylpyrrole

Chemical Property:

• PSA: 4.93000
• LogP: 3.02290
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 4
• Exact Mass: 165.151749610
• Heavy Atom Count: 12
• Complexity: 110

Purity/Quality:

95% ^*data from raw suppliers

2,5-DIETHYL-1-PROPYLPYRROLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN1C(=CC=C1CC)CC

Technology Process of 2,5-Diethyl-1-propylpyrrole

There total 2 articles about 2,5-Diethyl-1-propylpyrrole 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: 90.0%

propylamine (107-10-8,42939-71-9) + octane-3,6-dione (2955-65-9) → 1-propyl-2,5-diethylpyrrole (123147-20-6)

Guidance literature:

With montmorrillonite K₁₀; for 24h; Ambient temperature; further alkylamines;

Reference yield:

1-propyl-2,5-diethylpyrrole (123147-20-6) → 2,5-Diethyl-1-propyl-1H-pyrrole (123147-20-6)

Guidance literature:

With mercury(II) trifluoroacetate; In trifluoroacetic acid; Irradiation;

Reference yield:

1-propyl-2,5-diethylpyrrole (123147-20-6) → 2,5-Diethyl-1-propyl-1H-pyrrole (123147-20-6)

Guidance literature:

With mercury(II) trifluoroacetate; In trifluoroacetic acid; Irradiation;

upstream raw materials:

propylamine

octane-3,6-dione

Refernces

• 1、 Davies, Alwyn G.,Julia, Luis,Yazdi, Safieh N.. "An Electron Spin Resonance Study of the Radical Cations of Pyrroles, Furans, and Thiophenes in Liquid Solution". . p. 239 - 244. Retrieved 2007/10/02.