Pyrrolidine, 1-[(4-chlorophenyl)azo]-

Base Information

• Chemical Name: Pyrrolidine, 1-[(4-chlorophenyl)azo]-
• CAS No.: 62499-16-5
• Molecular Formula: C10H12ClN3
• Molecular Weight: 209.678
• ChEMBL ID: CHEMBL573624
• DSSTox Substance ID: DTXSID10465782
• Nikkaji Number: J2.019.057D

Synonyms:Pyrrolidine, 1-[(4-chlorophenyl)azo]-;62499-16-5;CHEMBL573624;DTXSID10465782;(E)-(4-chlorophenyl)-pyrrolidin-1-yl-diazene

Chemical Property of Pyrrolidine, 1-[(4-chlorophenyl)azo]-

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 209.0719751
• Heavy Atom Count: 14
• Complexity: 194

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(C1)N=NC2=CC=C(C=C2)Cl

Technology Process of Pyrrolidine, 1-[(4-chlorophenyl)azo]-

There total 3 articles about Pyrrolidine, 1-[(4-chlorophenyl)azo]- 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: 95.0%

pyrrolidine (123-75-1) + 4-chloro-aniline (106-47-8) → (E)-1-((4-chlorophenyl)diazenyl)pyrrolidine (62499-16-5)

Guidance literature:

4-chloro-aniline; With hydrogenchloride; sodium nitrite; In water; acetonitrile; at -5 - 0 ℃; for 0.5h;

pyrrolidine; With potassium carbonate; In water; acetonitrile; at 0 ℃;

DOI:10.1002/anie.201301742

Reference yield: 77.0%

(4-chlorphenyl)magnesium bromide (873-77-8) + 1-azido-4-iodobutane (148759-55-1) → (E)-1-((4-chlorophenyl)diazenyl)pyrrolidine (62499-16-5)

Guidance literature:

In tetrahydrofuran; at 50 ℃; for 3h; Inert atmosphere;

DOI:10.1021/acs.orglett.8b01214

Reference yield:

pyrrolidine (123-75-1) + 4-chlorophenyldiazonium salt (17333-85-6) → (E)-1-((4-chlorophenyl)diazenyl)pyrrolidine (62499-16-5)

Guidance literature:

With sodium hydroxide; water; at 70 ℃;

upstream raw materials:

pyrrolidine

4-chlorophenyldiazonium salt

4-chloro-aniline

(4-chlorphenyl)magnesium bromide

Downstream raw materials:

(4-chlorophenylthio)acetic acid

2-(4-chlorophenyl)pyrrolidine

4-chloro-4'-methylbiphenyl

(E)-1-(4-chlorophenyl)-2-phenylethene

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