4-Methyl-1-piperazinepropionic acid Hydrochloride

Base Information

• Chemical Name: 4-Methyl-1-piperazinepropionic acid Hydrochloride
• CAS No.: 775349-40-1
• Molecular Formula: C8H16 N2 O2 . Cl H
• Molecular Weight: 208.69
• Hs Code.: 2933599090
• European Community (EC) Number: 874-466-6
• DSSTox Substance ID: DTXSID60480309
• Mol file: 775349-40-1.mol

Synonyms:775349-40-1;4-Methyl-1-piperazinepropionic acid Hydrochloride;3-(4-Methylpiperazin-1-yl)propanoic acid hydrochloride;4-Methyl-1-piperazinepropanoic acid hydrochloride;3-(4-methylpiperazin-1-yl)propanoic acid;hydrochloride;SCHEMBL1128075;DTXSID60480309;AC6804;MFCD03452741;AKOS022183233;AC-23530;AM804354;AS-82251;SY013363;CS-0217387;FT-0756884;EN300-7414286;A865205;3-(4-Methylpiperazin-1-yl)propanoicacidhydrochloride;3-(N-Methylpiperazine)-propan-1-oic acid, hydrochloride;3-(4-Methylpiperazin-1-yl)propanoic acid--hydrogen chloride (1/1)

Chemical Property of 4-Methyl-1-piperazinepropionic acid Hydrochloride

Chemical Property:

• PSA: 43.78000
• LogP: 0.38630
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 208.0978555
• Heavy Atom Count: 13
• Complexity: 153

Purity/Quality:

97% ^*data from raw suppliers

4-Methyl-1-piperazinepropionicAcidHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCN(CC1)CCC(=O)O.Cl

Technology Process of 4-Methyl-1-piperazinepropionic acid Hydrochloride

There total 2 articles about 4-Methyl-1-piperazinepropionic 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: 82.0%

tert-butyl 3-(4-methylpiperazin-1-yl)propanoate → 3-(4-methylpiperazin-1-yl)propanoic acid hydrochloride (775349-40-1,59695-29-3)

Guidance literature:

With hydrogenchloride; water; at 110 ℃; for 3h;

Reference yield:

1-methyl-piperazine (109-01-3) → 3-(4-methylpiperazin-1-yl)propanoic acid hydrochloride (775349-40-1,59695-29-3)

Guidance literature:

Multi-step reaction with 2 steps

1: ethyl acetate / 3 h / Heating

2: hydrogenchloride; water / 3 h / 110 °C

With hydrogenchloride; water; In ethyl acetate;

Reference yield:

2-hexylmercapto-6-(3,4,5-trimethoxyphenyl)pyrimidine-4-methylamine hydrochloride + 3-(4-methylpiperazin-1-yl)propanoic acid hydrochloride (775349-40-1,59695-29-3) → 3-(4-methylpiperazinyl)propionic acid 2-hexylmercapto-6-(3,4,5-trimethoxy-phenyl)pyrimidine-4-methylamide

Guidance literature:

With benzotriazol-1-ol; O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine; at 4 - 20 ℃; for 3.5h;

upstream raw materials:

1-methyl-piperazine