alpha-((4-Nitrophenoxy)methyl)-4-phenyl-1-piperazineethanol

Base Information

• Chemical Name: alpha-((4-Nitrophenoxy)methyl)-4-phenyl-1-piperazineethanol
• CAS No.: 64511-26-8
• Molecular Formula: C19H23 N3 O4
• Molecular Weight: 357.4036
• DSSTox Substance ID: DTXSID40983080

Synonyms:BRN 0578783;1-(4-nitrophenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol;alpha-((4-Nitrophenoxy)methyl)-4-phenyl-1-piperazineethanol;1-Piperazineethanol, alpha-((4-nitrophenoxy)methyl)-4-phenyl-;64511-26-8;Oprea1_575588;Oprea1_764467;DTXSID40983080;AKOS001647929;AKOS016287570;LS-112509;AB00108823-01

Chemical Property of alpha-((4-Nitrophenoxy)methyl)-4-phenyl-1-piperazineethanol

Chemical Property:

• Vapor Pressure: 1.65E-13mmHg at 25°C
• Boiling Point: 562.9°Cat760mmHg
• Flash Point: 294.2°C
• PSA: 81.76000
• Density: 1.254g/cm³
• LogP: 2.68280
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 357.16885622
• Heavy Atom Count: 26
• Complexity: 423

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=CC=C3

Technology Process of alpha-((4-Nitrophenoxy)methyl)-4-phenyl-1-piperazineethanol

There total 3 articles about alpha-((4-Nitrophenoxy)methyl)-4-phenyl-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) → 1-(4-nitro-phenoxy)-3-(4-phenyl-piperazin-1-yl)-propan-2-ol (64511-26-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 1 N NaOH / 10 h

2: ethanol / 4 h / Heating

With sodium hydroxide; In ethanol;

DOI:10.1021/jm00109a007

Reference yield:

4-phenyl-1-piperazine (92-54-6) + 4-nitrophenyl 2-oxiranylmethyl ether (125228-75-3) → 1-(4-nitro-phenoxy)-3-(4-phenyl-piperazin-1-yl)-propan-2-ol (64511-26-8)

Guidance literature:

In ethanol; for 4h; Heating;

DOI:10.1021/jm00109a007

Reference yield:

→ 1-(4-nitro-phenoxy)-3-(4-phenyl-piperazin-1-yl)-propan-2-ol (64511-26-8)

Guidance literature:

aus p-Nitrophenoxy-2,3-epoxypropan u. N-Phenyl-piperazin;

upstream raw materials:

4-phenyl-1-piperazine

4-nitrophenyl 2-oxiranylmethyl ether

4-nitro-phenol

Downstream raw materials:

1-(4-methanesulfonylamino-phenoxy)-3-(4-phenyl-piperazin-1-yl)-propan-2-ol

1-(4-Aminophenoxy)-3-(N-phenylpiperazino)-2-propanol

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