(2-Oxo-2-piperazin-1-yl-ethyl)-carbamic acid tert-butyl ester

Base Information

• Chemical Name: (2-Oxo-2-piperazin-1-yl-ethyl)-carbamic acid tert-butyl ester
• CAS No.: 525587-00-2
• Molecular Formula: C11H21N3O3
• Molecular Weight: 243.3
• Hs Code.: 2933599090
• European Community (EC) Number: 675-197-5
• DSSTox Substance ID: DTXSID00590451
• Wikidata: Q82484145
• Mol file: 525587-00-2.mol

Synonyms:525587-00-2;(2-Oxo-2-piperazin-1-yl-ethyl)-carbamic acid tert-butyl ester;tert-Butyl (2-oxo-2-(piperazin-1-yl)ethyl)carbamate;tert-butyl N-[2-oxo-2-(piperazin-1-yl)ethyl]carbamate;tert-butyl N-(2-oxo-2-piperazin-1-ylethyl)carbamate;1-(boc-amino-acetyl)-piperazine;MFCD06796416;tert-Butyl [2-oxo-2-(piperazin-1-yl)ethyl]carbamate;tert-Butyl N-(2-oxo-2-(piperazin-1-yl)ethyl)carbamate;tert-butyl (2-oxo-2-piperazin-1-ylethyl)carbamate;SCHEMBL1222794;1-(Boc-aminoacetyl)-piperazine;TERT-BUTYL 2-OXO-2-PIPERAZIN-1-YLETHYLCARBAMATE;DTXSID00590451;PVPLWNKSNCRQIL-UHFFFAOYSA-N;AKOS013088284;BS-42883;CS-0183513;EN300-89969;P19142;A829145;tert-Butyl(2-oxo-2-(piperazin-1-yl)ethyl)carbamate;tert-butyl-[2-oxo-2-(1-piperazinyl)ethyl]carbamate;tert-butyl n-(2-oxo-2-piperazin-1-yl-ethyl)carbamate;1-dimethylethyl [2-oxo-2-(1-piperazinyl)ethyl]carbamate;1,1-dimethylethyl [2-oxo-2-(1-piperazinyl)ethyl]carbamate;(2-OXO-2-PIPERAZIN-1-YL-ETHYL)-CARBAMICACIDTERT-BUTYLESTER;(2-oxo-2-Piperazin-1-yl-ethyl)-carbamic acid tert-butyl ester, AldrichCPR

Chemical Property of (2-Oxo-2-piperazin-1-yl-ethyl)-carbamic acid tert-butyl ester

Chemical Property:

• Vapor Pressure: 4.63E-07mmHg at 25°C
• Refractive Index: 1.485
• Boiling Point: 413.9°C at 760 mmHg
• Flash Point: 204.1°C
• PSA: 70.67000
• Density: 1.107g/cm³
• LogP: 0.60050
• Storage Temp.: 2-8°C
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 243.15829154
• Heavy Atom Count: 17
• Complexity: 280

Purity/Quality:

98% ^*data from raw suppliers

tert-Butyl N-[2-oxo-2-(piperazin-1-yl)ethyl]carbamate 98.0% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NCC(=O)N1CCNCC1

Technology Process of (2-Oxo-2-piperazin-1-yl-ethyl)-carbamic acid tert-butyl ester

There total 6 articles about (2-Oxo-2-piperazin-1-yl-ethyl)-carbamic acid tert-butyl 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: 75.0%

[2-(4-benzyl-piperazin-1-yl)-2-oxo-ethyl]-carbamic acid tert-butyl ester (671212-34-3) → tert-butyl (2-oxo-2-(piperazin-1-yl)ethyl)carbamate (525587-00-2)

Guidance literature:

With ammonium formate; palladium on activated charcoal; In methanol; for 8h; Heating;

DOI:10.1016/j.bmc.2003.10.025

Reference yield: 71.0%

piperazine (110-85-0) → tert-butyl (2-oxo-2-(piperazin-1-yl)ethyl)carbamate (525587-00-2)

Guidance literature:

BOC-glycine; With benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; triethylamine; In dichloromethane; for 0.0833333h;

piperazine; In dichloromethane; for 20h;

Reference yield:

piperazine (110-85-0) + BOC-glycine (4530-20-5) → tert-butyl (2-oxo-2-(piperazin-1-yl)ethyl)carbamate (525587-00-2)

Guidance literature:

BOC-glycine; With HATU; In N,N-dimethyl acetamide; at 20 ℃; for 0.333333h;

piperazine; In N,N-dimethyl acetamide; at 20 ℃; for 17h;

upstream raw materials:

[2-(4-benzyl-piperazin-1-yl)-2-oxo-ethyl]-carbamic acid tert-butyl ester

BOC-glycine

piperazine

phenylmethyl 1-piperazinecarboxylate

Downstream raw materials:

2-amino-1-[4-(4-fluoro-benzenesulfonyl)-piperazin-1-yl]-ethanone

2-amino-1-(4-benzoyl-piperazin-1-yl)-ethanone

[2-(4-benzoyl-piperazin-1-yl)-2-oxo-ethyl]-carbamic acid tert-butyl ester

{2-[4-(4-fluoro-benzenesulfonyl)-piperazin-1-yl]-2-oxo-ethyl}-carbamic acid tert-butyl ester