4-(2-(Pyrrolidin-1-yl)ethoxy)aniline

Base Information

• Chemical Name: 4-(2-(Pyrrolidin-1-yl)ethoxy)aniline
• CAS No.: 50609-01-3
• Molecular Formula: C12H18 N2 O
• Molecular Weight: 206.288
• Hs Code.: 2933990090
• European Community (EC) Number: 690-003-9
• DSSTox Substance ID: DTXSID50424631
• Wikidata: Q72505329
• Mol file: 50609-01-3.mol

Synonyms:4-(2-(pyrrolidin-1-yl)ethoxy)aniline;50609-01-3;4-(2-Pyrrolidin-1-yl-ethoxy)-phenylamine;4-[2-(pyrrolidin-1-yl)ethoxy]aniline;4-(2-pyrrolidin-1-ylethoxy)aniline;4-(2-(pyrrolidin-1-yl)ethoxy)benzenamine;Benzenamine, 4-[2-(1-pyrrolidinyl)ethoxy]-;SCHEMBL56495;SCHEMBL3578343;AMY5575;DTXSID50424631;OTYZNDKWNPQQJP-UHFFFAOYSA-N;4-(2-pyrrolidinoethoxy)phenylamine;BBL036432;MFCD07790198;STK397423;AKOS000302268;AC-5444;DS-12892;4-(2-pyrrolidin-1 -yl-ethoxy)-phenylamine;BB 0258196;CS-0135274;FT-0678767;[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-amine;EN300-7406746;A828201;J-513246;4-(2-(Pyrrolidin-1-yl)ethoxy)aniline

Chemical Property of 4-(2-(Pyrrolidin-1-yl)ethoxy)aniline

Chemical Property:

• Vapor Pressure: 1.96E-05mmHg at 25°C
• Boiling Point: 362.2°C at 760 mmHg
• PKA: 9.76±0.20(Predicted)
• Flash Point: 172.9°C
• PSA: 38.49000
• Density: 1.097g/cm³
• LogP: 2.26250
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 206.141913202
• Heavy Atom Count: 15
• Complexity: 173

Purity/Quality:

97% ^*data from raw suppliers

4-(2-(Pyrrolidin-1-yl)ethoxy)aniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(C1)CCOC2=CC=C(C=C2)N

Technology Process of 4-(2-(Pyrrolidin-1-yl)ethoxy)aniline

There total 15 articles about 4-(2-(Pyrrolidin-1-yl)ethoxy)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: 99.88%

1-(2-(4-nitrophenoxy)ethyl)pyrrolidine (265654-77-1) → 4-(2-pyrrolidinoethoxy)aniline (50609-01-3)

Guidance literature:

With hydrogen; palladium 10% on activated carbon; In methanol;

Reference yield: 98.0%

→ 4-(2-pyrrolidinoethoxy)aniline (50609-01-3)

Guidance literature:

Reference yield: 92.0%

1-(2-chloroethyl)pyrrolidine hydrochloride (7250-67-1) + 4-amino-phenol (123-30-8) → 4-(2-pyrrolidinoethoxy)aniline (50609-01-3)

Guidance literature:

With sodium hydroxide; In N,N-dimethyl-formamide; at 75 ℃; for 2h;

DOI:10.1021/jm060368s

upstream raw materials:

1-(2-(4-nitrophenoxy)ethyl)pyrrolidine

1-(2-(4-nitrophenoxy)ethyl)pyrrolidine hydrochloride

1-(2-chloroethyl)pyrrolidine hydrochloride

4-amino-phenol

Downstream raw materials:

(5-methyl-benzothiazol-2-yl)-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-amine

(5-methyl-benzooxazol-2-yl)-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-amine

2-Chloro-3-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-propionic acid methyl ester

1-[2-(4-isothiocyanato-phenoxy)-ethyl]-pyrrolidine