4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol

Base Information

• Chemical Name: 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol
• CAS No.: 64511-36-0
• Molecular Formula: C₁₉H₂₂ClN₃O₄
• Molecular Weight: 391.854
• DSSTox Substance ID: DTXSID20983088

Synonyms:BRN 0584567;1-Piperazineethanol, 4-(4-chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-;4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol;64511-36-0;C19H22ClN3O4;DTXSID20983088;1-[4-(4-chlorophenyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol;LS-112212;AB00039993-01

Chemical Property of 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol

Chemical Property:

• Vapor Pressure: 1.31E-14mmHg at 25°C
• Boiling Point: 586.7°Cat760mmHg
• Flash Point: 308.6°C
• Density: 1.319g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 391.1298839
• Heavy Atom Count: 27
• Complexity: 454

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1CC(COC2=CC=C(C=C2)[N+](=O)[O-])O)C3=CC=C(C=C3)Cl

Technology Process of 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol

There total 2 articles about 4-(4-Chlorophenyl)-alpha-((4-nitrophenoxy)methyl)-1-piperazineethanol 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:

4-nitro-phenol (100-02-7,78813-13-5,89830-32-0) + 4-(4-chlorophenyl) piperazine (38212-33-8) + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) → 1-[4-(4-chloro-phenyl)-piperazin-1-yl]-3-(4-nitro-phenoxy)-propan-2-ol (64511-36-0)

Guidance literature:

Multistep reaction; 2) isopropanol, 5 h, reflux;

Reference yield:

→ 1-[4-(4-chloro-phenyl)-piperazin-1-yl]-3-(4-nitro-phenoxy)-propan-2-ol (64511-36-0)

Guidance literature:

aus p-Nitrophenoxy-2,3-epoxypropan u. N-(4-Chlor)-phenyl-piperazin;

upstream raw materials:

4-nitro-phenol

4-(4-chlorophenyl) piperazine

epichlorohydrin

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