1-Methyl-3-phenylpiperazin-2-one

Base Information

• Chemical Name: 1-Methyl-3-phenylpiperazin-2-one
• CAS No.: 799796-66-0
• Molecular Formula: C11H14 N2 O
• Molecular Weight: 190.245
• DSSTox Substance ID: DTXSID10461209
• Mol file: 799796-66-0.mol

Synonyms:1-METHYL-3-PHENYLPIPERAZIN-2-ONE;799796-66-0;1-methyl-2-oxo-3-phenylpiperazine;SCHEMBL6068770;DTXSID10461209;GHFORXSVFVCFSN-UHFFFAOYSA-N;1-methyl(phenyl)-piperazin-2-one;CS-B1169;Piperazinone,1-methyl-3-phenyl-(9ci);FT-0700558;EN300-6766510

Chemical Property of 1-Methyl-3-phenylpiperazin-2-one

Chemical Property:

• Boiling Point: 359.4±42.0 °C(Predicted)
• PKA: 6.67±0.40(Predicted)
• PSA: 32.34000
• Density: 1.091±0.06 g/cm3(Predicted)
• LogP: 1.05600
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 190.110613074
• Heavy Atom Count: 14
• Complexity: 211

Purity/Quality:

NLT 98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCNC(C1=O)C2=CC=CC=C2

Technology Process of 1-Methyl-3-phenylpiperazin-2-one

There total 1 articles about 1-Methyl-3-phenylpiperazin-2-one 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-benzyl-1-methyl-2-oxo-3-phenylpiperazine (799796-64-8) → 1-methyl-2-oxo-3-phenylpiperazine (799796-66-0)

Guidance literature:

4-benzyl-1-methyl-2-oxo-3-phenylpiperazine; With hydrogen; 5%-palladium/activated carbon; In acetic acid; under 5171.62 Torr;

With sodium hydroxide; In water; pH=11 - 12;

Reference yield:

1-methyl-2-oxo-3-phenylpiperazine (799796-66-0) → 1-methyl-3-phenylpiperazine (5271-27-2)

Guidance literature:

1-methyl-2-oxo-3-phenylpiperazine; With lithium aluminium tetrahydride; In tetrahydrofuran; at 10 - 15 ℃; for 2h; Heating / reflux;

With sodium hydroxide; water; In tetrahydrofuran;

upstream raw materials:

4-benzyl-1-methyl-2-oxo-3-phenylpiperazine

Downstream raw materials:

1-methyl-3-phenylpiperazine

Refernces