2-Butylpyrrolidine

Base Information

• Chemical Name: 2-Butylpyrrolidine
• CAS No.: 3446-98-8
• Molecular Formula: C8H17 N
• Molecular Weight: 127.23
• Hs Code.: 2933998090
• DSSTox Substance ID: DTXSID90397951
• Nikkaji Number: J3.626.875A
• Mol file: 3446-98-8.mol

Synonyms:2-butylpyrrolidine;3446-98-8;2-Butyl-pyrrolidine;Pyrrolidine,2-butyl-;SCHEMBL3334797;DTXSID90397951;CKHOSERPJPIUIL-UHFFFAOYSA-N;BBL020747;MFCD02663449;STK893437;AKOS000154592;AKOS016343920;AB12052;BB 0249506;CS-0297439;J3.626.875A;N12661;EN300-1263932;A822248;F8881-8301

Chemical Property of 2-Butylpyrrolidine

Chemical Property:

• Vapor Pressure: 1.43mmHg at 25°C
• Refractive Index: 1.4490 (estimate)
• Boiling Point: 226.06°C (rough estimate)
• Density: 0.8277
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 127.136099547
• Heavy Atom Count: 9
• Complexity: 71

Purity/Quality:

97% ^*data from raw suppliers

2-Butylpyrrolidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1CCCN1

Technology Process of 2-Butylpyrrolidine

There total 19 articles about 2-Butylpyrrolidine 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%

tert-Butyl-[1-(2-butyl-pyrrolidin-1-yl)-meth-(E)-ylidene]-amine (89656-28-0) → 2-n-Butylpyrrolidine (3446-98-8)

Guidance literature:

With hydrazine; In ethanol; acetic acid; at 50 ℃; for 15h;

DOI:10.1021/ja00323a035

Reference yield: 25.0%

1-pyrroline (5724-81-2) + n-butyllithium (109-72-8,29786-93-4) → 2-n-Butylpyrrolidine (3446-98-8)

Guidance literature:

In diethyl ether; for 0.5h; Ambient temperature;

DOI:10.1021/jo01296a036

Reference yield:

pyrrolidine (123-75-1) → 2-n-Butylpyrrolidine (3446-98-8)

Guidance literature:

With ammonia; hydrogen; cobalt; at 200 ℃; under 147102 Torr;

upstream raw materials:

pyrrolidine

2-butyl-1H-pyrrole

sodium ethanolate

1-pyrroline

Downstream raw materials:

2-Butyl-pyrrolidine-1-carboxylic acid phenylamide