3-Propylpyrrolidine

Base Information

• Chemical Name: 3-Propylpyrrolidine
• CAS No.: 116632-47-4
• Molecular Formula: C₇H₁₅N
• Molecular Weight: 113.203
• European Community (EC) Number: 859-112-0
• DSSTox Substance ID: DTXSID00505626
• Mol file: 116632-47-4.mol

Synonyms:3-PROPYLPYRROLIDINE;116632-47-4;Pyrrolidine, 3-propyl-;3-Propyl-pyrrolidine;SCHEMBL293018;DTXSID00505626;RKFKEXKTXWGBCN-UHFFFAOYSA-N;MFCD07383545;AKOS005174162;LS-04154;CS-0205315;FT-0681571;EN300-96274;F8887-7041;Z940902738

Chemical Property of 3-Propylpyrrolidine

Chemical Property:

• Vapor Pressure: 2.556mmHg at 25°C
• Refractive Index: 1.4469
• Boiling Point: 158.999°C at 760 mmHg
• Flash Point: 34.474°C
• PSA: 12.03000
• Density: 0.815g/cm³
• LogP: 1.72480
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 113.120449483
• Heavy Atom Count: 8
• Complexity: 61.4

Purity/Quality:

98%min ^*data from raw suppliers

3-Propylpyrrolidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1CCNC1

Technology Process of 3-Propylpyrrolidine

There total 4 articles about 3-Propylpyrrolidine 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:

→ 3-propyl-pyrrolidine (116632-47-4)

Guidance literature:

With aluminum oxide; ammonia; at 350 ℃;

Reference yield:

3-hydroxymethylhexan-1-ol (62946-68-3) → 3-propyl-pyrrolidine (116632-47-4)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrobromic acid

2: 150 °C / im Rohr

With hydrogen bromide;

Reference yield:

(+/-)-1-bromo-3-bromomethyl-hexane (861567-92-2) + ammonia (7664-41-7) → 3-propyl-pyrrolidine (116632-47-4)

Guidance literature:

at 150 ℃; im Rohr;

upstream raw materials:

(+/-)-1-bromo-3-bromomethyl-hexane

ammonia

3-Propyl-tetrahydro-furan

3-hydroxymethylhexan-1-ol