(4-Phenylpiperazin-1-yl)acetic acid hydrochloride

Base Information

• Chemical Name: (4-Phenylpiperazin-1-yl)acetic acid hydrochloride
• CAS No.: 119378-70-0
• Molecular Formula: C13H19ClN2O2
• Molecular Weight: 220.271
• European Community (EC) Number: 675-177-6
• DSSTox Substance ID: DTXSID20589408
• Mol file: 119378-70-0.mol

Synonyms:119378-70-0;(4-phenylpiperazin-1-yl)acetic acid hydrochloride;(4-Phenyl-piperazin-1-yl)-acetic acid hydrochloride;2-(4-phenylpiperazin-1-yl)acetic acid;hydrochloride;MFCD06796404;1158495-29-4;(4-phenyl-piperazin-1-yl)-acetic acid hcl;(4-phenyl-piperazin-1-yl)-acetic acidhydrochloride;(4-Phenyl-piperazin-1-yl)-aceticacidhydrochloride98%;(4-PHENYL-PIPERAZIN-1-YL)-ACETIC ACID X HCL;2-(4-phenylpiperazin-1-yl)acetic acid hydrochloride;SCHEMBL1374296;DTXSID20589408;QCIYPWMAGHVMQC-UHFFFAOYSA-N;AKOS015996740;FS-4720;(4-phenylpiperazin-1-yl)acetic acid HCl;DB-016576;(4-PHENYL-PIPERAZIN-1-YL)-ACETICACIDXHCL;(4-Phenylpiperazin-1-yl)acetic acid--hydrogen chloride (1/1)

Chemical Property of (4-Phenylpiperazin-1-yl)acetic acid hydrochloride

Chemical Property:

• Vapor Pressure: 1.06E-07mmHg at 25°C
• Boiling Point: 417°C at 760 mmHg
• PKA: 4.24±0.10(Predicted)
• Flash Point: 206°C
• PSA: 43.78000
• Density: 1.190±0.06 g/cm3(Predicted)
• LogP: 0.89610
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 256.0978555
• Heavy Atom Count: 17
• Complexity: 231

Purity/Quality:

97% ^*data from raw suppliers

(4-Phenylpiperazin-1-yl)aceticAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1CC(=O)O)C2=CC=CC=C2.Cl

Technology Process of (4-Phenylpiperazin-1-yl)acetic acid hydrochloride

There total 3 articles about (4-Phenylpiperazin-1-yl)acetic acid hydrochloride 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: 90.0%

→ (4-phenyl-1-piperazinyl)acetic acid (119378-70-0)

Guidance literature:

Reference yield:

ethyl 2-(4-phenyl-piperarazin-1-yl)acetate (56968-26-4) → (4-phenyl-1-piperazinyl)acetic acid (119378-70-0)

Guidance literature:

With hydrogen bromide;

Reference yield:

4-phenyl-1-piperazine (92-54-6) → (4-phenyl-1-piperazinyl)acetic acid (119378-70-0)

Guidance literature:

With water; sodium monochloroacetic acid; sodium carbonate;

DOI:10.1021/ja01311a014

upstream raw materials:

4-phenyl-1-piperazine

ethyl 2-(4-phenyl-piperarazin-1-yl)acetate

Downstream raw materials:

(4-Phenyl-piperazin-1-yl)-acetic acid (2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-2-ylmethyl ester

1-t-butoxycarbonylamino-3-(1H-indol-3-yl)-2-[N-(2-((4-phenyl)piperazin-1-yl)acetyl)amino]propane