1-(4-Fluorobenzyl)pyrrolidin-3-ylamine dihydrochloride

Base Information

• Chemical Name: 1-(4-Fluorobenzyl)pyrrolidin-3-ylamine dihydrochloride
• CAS No.: 169452-08-8
• Molecular Formula: C₁₁H₁₅FN₂*ClH
• Molecular Weight: 230.713
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID30697982
• Mol file: 169452-08-8.mol

Synonyms:169452-08-8;1-(4-fluorobenzyl)pyrrolidin-3-ylamine dihydrochloride;1-(4-Fluorobenzyl)pyrrolidin-3-amine dihydrochloride;1-[(4-fluorophenyl)methyl]pyrrolidin-3-amine;dihydrochloride;1-(4-FLUORO-BENZYL)-PYRROLIDIN-3-YLAMINE DIHYDROCHLORIDE;DTXSID30697982;DCEZYLVPEAGIBW-UHFFFAOYSA-N;1-(4-fluorobenzyl)pyrrolidin-3-ylamine 2HCl;1-(4-Fluorobenzyl)pyrrolidin-3-aminedihydrochloride;1-[(4-Fluorophenyl)methyl]pyrrolidin-3-amine--hydrogen chloride (1/2)

Chemical Property of 1-(4-Fluorobenzyl)pyrrolidin-3-ylamine dihydrochloride

Chemical Property:

• PSA: 29.26000
• LogP: 3.60090
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 266.0752821
• Heavy Atom Count: 16
• Complexity: 178

Purity/Quality:

98%min ^*data from raw suppliers

1-(4-FLUORO-BENZYL)-PYRROLIDIN-3-YLAMINE DIHYDROCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CC1N)CC2=CC=C(C=C2)F.Cl.Cl

Technology Process of 1-(4-Fluorobenzyl)pyrrolidin-3-ylamine dihydrochloride

There total 2 articles about 1-(4-Fluorobenzyl)pyrrolidin-3-ylamine dihydrochloride 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-N-tert-butoxycarbonyl-3-(R)-aminopyrrolidine (122536-77-0,140629-77-2) + 4-Fluorobenzyl bromide (459-46-1) → (R)-1-(4-fluorobenzyl)pyrrolidin-3-amine hydrochloride (169452-08-8)

Guidance literature:

3-N-tert-butoxycarbonyl-3-(R)-aminopyrrolidine; 4-Fluorobenzyl bromide; In chloroform; at 20 ℃; for 24h;

With hydrogenchloride; In 1,4-dioxane; chloroform; for 24h;

Reference yield:

→ (S)-1-(4-fluorobenzyl)pyrrolidin-3-amine hydrochloride (169452-08-8)

Guidance literature:

In chloroform; at 20 ℃; for 24h;

With hydrogenchloride; In 1,4-dioxane; chloroform; for 24h;

upstream raw materials:

3-N-tert-butoxycarbonyl-3-(R)-aminopyrrolidine

4-Fluorobenzyl bromide

Refernces