4-(Pyrrolidin-1-yl)aniline

Base Information

• Chemical Name: 4-(Pyrrolidin-1-yl)aniline
• CAS No.: 2632-65-7
• Molecular Formula: C10H14N2
• Molecular Weight: 162.235
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID10355614
• Nikkaji Number: J2.097.019G
• Wikidata: Q72505265
• Mol file: 2632-65-7.mol

Synonyms:4-(pyrrolidin-1-yl)aniline;2632-65-7;4-pyrrolidin-1-ylaniline;4-(1-pyrrolidinyl)aniline;4-Pyrrolidin-1-yl-phenylamine;(4-pyrrolidin-1-ylphenyl)amine;MFCD00156245;1-(4-Aminophenyl)pyrrolidine;Benzenamine,4-(1-pyrrolidinyl)-;Benzenamine, 4-(1-pyrrolidinyl)-;4-(1-pyrrolidinyl)-aniline;Oprea1_595659;Oprea1_774483;SCHEMBL33852;4-Pyrrolidin-1-ylphenylamine;4-(Pyrrolidin-1-yl)phenylamine;4-pyrrolidinoaniline, AldrichCPR;DTXSID10355614;URAARCWOADCWLA-UHFFFAOYSA-N;HMS1672L09;STK123896;AKOS000103150;10G-314S;AM807173;BAS 01890970;BB 0245666;CS-0146890;FT-0715361;EN300-35340;C74362;A818383;J-513853;4-(Pyrrolidin-1-yl)aniline;F2169-1100

Chemical Property of 4-(Pyrrolidin-1-yl)aniline

Chemical Property:

• Vapor Pressure: 0.000162mmHg at 25°C
• Melting Point: 51 °C
• Refractive Index: 1.609
• Boiling Point: 330.8 °C at 760 mmHg
• PKA: 7.20±0.40(Predicted)
• Flash Point: 131.3 °C
• PSA: 29.26000
• Density: 1.109 g/cm³
• LogP: 2.51520
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 162.115698455
• Heavy Atom Count: 12
• Complexity: 133

Purity/Quality:

99% ^*data from raw suppliers

4-Pyrrolidin-1-ylaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(C1)C2=CC=C(C=C2)N

Technology Process of 4-(Pyrrolidin-1-yl)aniline

There total 13 articles about 4-(Pyrrolidin-1-yl)aniline 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: 96.0%

4-(1-oxy-pyrrolidin-1-yl)-phenylamine → 4-pyrrolidin-1-yl-aniline (2632-65-7)

Guidance literature:

With copper(l) iodide; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; at 35 - 40 ℃; for 3h;

DOI:10.1016/j.tet.2006.10.031

Reference yield: 93.0%

1-(4-nitro-phenyl)-pyrrolidine (10220-22-1) → 4-pyrrolidin-1-yl-aniline (2632-65-7)

Guidance literature:

With hydrogen; In methanol; ethyl acetate; at 100 ℃; for 0.333333h; chemoselective reaction; Flow reactor; Green chemistry;

DOI:10.1039/C8NJ04646H

Reference yield: 80.0%

1-(4-nitrophenyl)piperidine (6574-15-8) → 4-pyrrolidin-1-yl-aniline (2632-65-7)

Guidance literature:

With palladium 10% on activated carbon; hydrazine hydrate; In ethanol; for 12h; Reflux;

upstream raw materials:

1-(4-nitro-phenyl)-pyrrolidine

1,4-dichlorobutane

1,4-phenylenediamine

tetrahydrofuran

Downstream raw materials:

N-(4-((4-(pyrrolidin-1-yl)phenylamino)methyl)benzyl)pyrimidin-2-amine

4-(4-(pyrrolidin-1-yl)phenylamino)-4-oxobutanoic acid

2-(1H-indol-3-yl)-2-oxo-N-(4-(pyrrolidin-1-yl)phenyl)acetamide

N-(2-chloro-6-methylphenyl)-2-((2-methyl-6-((4-(pyrrolidin-1-yl)phenyl)amino)pyrimidin-4-yl)amino)thiazole-5-carboxamide

Refernces

• 1、 Sivaraman, Aneesh,Kim, Dae Gyu,Bhattarai, Deepak,Kim, Minkyoung,Lee, Hwa Young,Lim, Semi,Kong, Jiwon,Goo, Ja-Il,Shim, Seunghwan,Lee, Seungbeom,Suh, Young-Ger,Choi, Yongseok,Kim, Sunghoon,Lee, Kyeong. "Synthesis and Structure-Activity Relationships of Arylsulfonamides as AIMP2-DX2 Inhibitors for the Development of a Novel Anticancer Therapy". . p. 5139 - 5158. Retrieved 2020/05/05.
• 2、 Sharma, Saurabh,Yamini,Das, Pralay. "Hydrogenation of nitroarenes to anilines in a flow reactor using polystyrene supported rhodium in a catalyst-cartridge (Cart-Rh@PS)". supporting information. p. 1764 - 1769. Retrieved 2019/01/28.