(S)-Piperazine-2-carboxylic acid methyl ester

Base Information

• Chemical Name: (S)-Piperazine-2-carboxylic acid methyl ester
• CAS No.: 198992-49-3
• Molecular Formula: C6H12N2O2
• Molecular Weight: 144.17
• DSSTox Substance ID: DTXSID00426589
• Wikidata: Q82239453
• Mol file: 198992-49-3.mol

Synonyms:198992-49-3;(S)-Methyl piperazine-2-carboxylate;(S)-PIPERAZINE-2-CARBOXYLIC ACID METHYL ESTER;methyl (2S)-piperazine-2-carboxylate;Methyl (S)-piperazine-2-carboxylate;2-Piperazinecarboxylicacid,methylester,(S)-(9ci);SCHEMBL5217160;DTXSID00426589;(S)-Methylpiperazine-2-carboxylate;AKOS015851042;CS-0200089;EN300-6992024;A814050;J-502518

Chemical Property of (S)-Piperazine-2-carboxylic acid methyl ester

Chemical Property:

• PSA: 50.36000
• LogP: -0.62160
• Storage Temp.: 2-8°C
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 144.089877630
• Heavy Atom Count: 10
• Complexity: 127

Purity/Quality:

99% ^*data from raw suppliers

(S)-Methylpiperazine-2-carboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1CNCCN1
• Isomeric SMILES: COC(=O)[C@@H]1CNCCN1

Technology Process of (S)-Piperazine-2-carboxylic acid methyl ester

There total 1 articles about (S)-Piperazine-2-carboxylic acid methyl 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:

methyl pyrazine-2-carboxylate (6164-79-0) + bicyclo[2.2.1]hepta-2,5-dienerhodium(I) chloride dimer + 1-[1(R)-(di-tert-butylphosphino)ethyl]-2(S)- (diphenylphosphino)ferrocene → Methyl (S)-piperazine-2-carboxylate (198992-49-3)

Guidance literature:

In methanol;

Reference yield:

Methyl (S)-piperazine-2-carboxylate (198992-49-3) + (2R,3S)-3-[N-(tert-butyloxycarbonyl)amino]-1,2-epoxy-4-phenylbutane (98760-08-8) → C21H33N3O5 (899838-31-4)

Guidance literature:

In tetrahydrofuran; for 48h; Reflux;

DOI:10.2174/1573406411208061146

upstream raw materials:

methyl pyrazine-2-carboxylate

Downstream raw materials:

C₂₁H₃₃N₃O₅

Refernces