alpha-Phenyl-4-(phenylmethyl)-1-piperazinepropanol acetate (ester)

Base Information

• Chemical Name: alpha-Phenyl-4-(phenylmethyl)-1-piperazinepropanol acetate (ester)
• CAS No.: 149848-05-5
• Molecular Formula: C₂₂H₂₈N₂O₂
• Molecular Weight: 352.477
• DSSTox Substance ID: DTXSID10933774
• Nikkaji Number: J534.845E
• Mol file: 149848-05-5.mol

Synonyms:alpha-Phenyl-4-(phenylmethyl)-1-piperazinepropanol acetate (ester);149848-05-5;[3-(4-benzylpiperazin-1-yl)-1-phenylpropyl] acetate;1-Piperazinepropanol, alpha-phenyl-4-(phenylmethyl)-, acetate (ester);DTXSID10933774;QZDHUBWWPZRLEY-UHFFFAOYSA-N;LS-113380;3-(4-BENZYLPIPERAZIN-1-YL)-1-PHENYLPROPYL ACETATE;Acetic acid 3-(4-benzylpiperazin-1-yl)-1-phenylpropyl ester

Chemical Property of alpha-Phenyl-4-(phenylmethyl)-1-piperazinepropanol acetate (ester)

Chemical Property:

• Vapor Pressure: 2.49E-09mmHg at 25°C
• Boiling Point: 478.8°Cat760mmHg
• Flash Point: 243.4°C
• PSA: 32.78000
• Density: 1.105g/cm³
• LogP: 3.37450
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 352.215078140
• Heavy Atom Count: 26
• Complexity: 408

Purity/Quality:

ALPHA-PHENYL-4-(PHENYLMETHYL)-1-PIPERAZINEPROPANOL ACETATE (ESTER) 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC(CCN1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC=C3

Technology Process of alpha-Phenyl-4-(phenylmethyl)-1-piperazinepropanol acetate (ester)

There total 1 articles about alpha-Phenyl-4-(phenylmethyl)-1-piperazinepropanol acetate (ester) 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: 91.0%

γ-(4-benzyl piperazin-1-yl)-α-phenyl propanol (41465-66-1) + acetyl chloride (75-36-5) → Acetic acid 3-(4-benzyl-piperazin-1-yl)-1-phenyl-propyl ester (149848-05-5)

Guidance literature:

With ammonium; sodium carbonate; In chloroform; for 3.5h;

upstream raw materials:

γ-(4-benzyl piperazin-1-yl)-α-phenyl propanol

acetyl chloride

Refernces