Tert-butyl 2,5,5-trimethylpiperazine-1-carboxylate

Base Information

• Chemical Name: Tert-butyl 2,5,5-trimethylpiperazine-1-carboxylate
• CAS No.: 308109-96-8
• Molecular Formula: C₁₂H₂₄N₂O₂
• Molecular Weight: 228.335
• European Community (EC) Number: 895-855-7

Synonyms:Tert-butyl 2,5,5-trimethylpiperazine-1-carboxylate;308109-96-8;1-Piperazinecarboxylic acid, 2,5,5-trimethyl-, 1,1-dimethylethyl ester;CS-WAA0032;RFKDQNITCIOVID-UHFFFAOYSA-N;MFCD13192794;AKOS022181955;AS-53682;CS-0035299;P16873;EN300-6505002;Tert-butyl2,5,5-trimethylpiperazine-1-carboxylate;2,5,5-trimethyl-piperazine-1-carbox ylic acid tert-butyl ester;2,5,5-Trimethyl-1-piperazinecarboxylic acid 1,1-dimethylethyl ester

Chemical Property of Tert-butyl 2,5,5-trimethylpiperazine-1-carboxylate

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 228.183778013
• Heavy Atom Count: 16
• Complexity: 269

Purity/Quality:

98%+ ^*data from raw suppliers

tert-Butyl2,5,5-trimethylpiperazine-1-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1CNC(CN1C(=O)OC(C)(C)C)(C)C

Technology Process of Tert-butyl 2,5,5-trimethylpiperazine-1-carboxylate

There total 4 articles about Tert-butyl 2,5,5-trimethylpiperazine-1-carboxylate 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:

3,3,6-trimethyl-2,5-piperazinedione (66449-54-5) → tert-butyl 2,5,5-trimethyl-1-piperazinecarboxylate (308109-96-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 84 percent / lithium aluminum hydride / tetrahydrofuran / Heating

2: 43 mg / K₂CO₃ / H₂O / 1 h

With lithium aluminium tetrahydride; potassium carbonate; In tetrahydrofuran; water; 1: Reduction / 2: Condensation;

DOI:10.1021/jm000228x

Reference yield:

Aib-Ala-OMe → tert-butyl 2,5,5-trimethyl-1-piperazinecarboxylate (308109-96-8)

Guidance literature:

Multi-step reaction with 3 steps

1: butan-2-ol / 4 h / Heating

2: 84 percent / lithium aluminum hydride / tetrahydrofuran / Heating

3: 43 mg / K₂CO₃ / H₂O / 1 h

With lithium aluminium tetrahydride; potassium carbonate; In tetrahydrofuran; water; iso-butanol; 1: Cyclization / 2: Reduction / 3: Condensation;

DOI:10.1021/jm000228x

Reference yield:

Boc-Aib-Ala-OMe (308110-34-1) → tert-butyl 2,5,5-trimethyl-1-piperazinecarboxylate (308109-96-8)

Guidance literature:

Multi-step reaction with 4 steps

1: HCO₂H / 12 h / 25 °C

2: butan-2-ol / 4 h / Heating

3: 84 percent / lithium aluminum hydride / tetrahydrofuran / Heating

4: 43 mg / K₂CO₃ / H₂O / 1 h

With lithium aluminium tetrahydride; formic acid; potassium carbonate; In tetrahydrofuran; water; iso-butanol; 1: Hydrolysis / 2: Cyclization / 3: Reduction / 4: Condensation;

DOI:10.1021/jm000228x

upstream raw materials:

di-tert-butyl dicarbonate

2,2,5-trimethylpiperazine

3,3,6-trimethyl-2,5-piperazinedione

Boc-Aib-Ala-OMe

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