(S)-1-(tert-Butoxycarbonyl)-5-oxopiperazine-2-carboxylic acid

Base Information

• Chemical Name: (S)-1-(tert-Butoxycarbonyl)-5-oxopiperazine-2-carboxylic acid
• CAS No.: 1033713-11-9
• Molecular Formula: C₁₀H₁₆N₂O₅
• Molecular Weight: 244.247
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID60659255
• Nikkaji Number: J2.785.571G
• Wikidata: Q82575908
• Mol file: 1033713-11-9.mol

Synonyms:(S)-1-(tert-Butoxycarbonyl)-5-oxopiperazine-2-carboxylic acid;1033713-11-9;(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-5-oxopiperazine-2-carboxylic acid;(2S)-1-(tert-Butoxycarbonyl)-5-oxopiperazine-2-carboxylic acid;(2S)-1-Boc-5-oxo-piperazine-2-carboxylic acid;SCHEMBL3833251;DTXSID60659255;PYQDNNRESXVUND-LURJTMIESA-N;(S)-1-(tert-Butoxycarbonyl)-5-oxopiperazine-2-carboxylicacid;MFCD10698231;AKOS016010589;CS-W021151;DS-5680;(S)-1-(Boc)-5-Oxopiperazine-2-carboxylic acid;A855231;(2S)-1-(tert-Butyloxycarbonyl)-5-oxopiperazine-2-carboxylic acid

Chemical Property of (S)-1-(tert-Butoxycarbonyl)-5-oxopiperazine-2-carboxylic acid

Chemical Property:

• PSA: 99.43000
• LogP: 0.02030
• Storage Temp.: 2-8°C
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 244.10592162
• Heavy Atom Count: 17
• Complexity: 347

Purity/Quality:

97% ^*data from raw suppliers

(S)-1-(tert-Butoxycarbonyl)-5-oxopiperazine-2-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CC(=O)NCC1C(=O)O
• Isomeric SMILES: CC(C)(C)OC(=O)N1CC(=O)NC[C@H]1C(=O)O

Technology Process of (S)-1-(tert-Butoxycarbonyl)-5-oxopiperazine-2-carboxylic acid

There total 1 articles about (S)-1-(tert-Butoxycarbonyl)-5-oxopiperazine-2-carboxylic acid 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: 88.0%

di-tert-butyl dicarbonate (24424-99-5) + (S)-5-oxo-piperazine-2-carboxylic acid methyl ester (1191885-41-2) → (S)-5-oxopiperazine-1,2-dicarboxylic acid 1-tert-butyl ester (1033713-11-9,1246553-28-5)

Guidance literature:

(S)-5-oxo-piperazine-2-carboxylic acid methyl ester; With sodium hydroxide; In 1,4-dioxane; water; at 20 ℃;

di-tert-butyl dicarbonate; In 1,4-dioxane; water; at 0 - 20 ℃; for 16h;

With potassium hydrogensulfate; In 1,4-dioxane; water; pH=3;

DOI:10.1021/jo901389q

upstream raw materials:

di-tert-butyl dicarbonate

(S)-5-oxo-piperazine-2-carboxylic acid methyl ester

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