4-(2-Hydroxyethyl)piperazine-1-carbaldehyde

Base Information

• Chemical Name: 4-(2-Hydroxyethyl)piperazine-1-carbaldehyde
• CAS No.: 25209-64-7
• Molecular Formula: C7H14N2O2
• Molecular Weight: 158.2
• Hs Code.: 2933599090
• European Community (EC) Number: 692-001-3
• DSSTox Substance ID: DTXSID40433095
• Nikkaji Number: J2.839.699F
• Mol file: 25209-64-7.mol

Synonyms:25209-64-7;4-(2-hydroxyethyl)piperazine-1-carbaldehyde;1-formyl-4-(2-hydroxyethyl)piperazine;1-Piperazinecarboxaldehyde, 4-(2-hydroxyethyl)-;SCHEMBL2087117;DTXSID40433095;IINWNNKUXOSZAI-UHFFFAOYSA-N;AKOS011419620;N-formyl-N-'-2-hydroxyethylpiperazine

Chemical Property of 4-(2-Hydroxyethyl)piperazine-1-carbaldehyde

Chemical Property:

• PSA: 43.78000
• LogP: -0.73560
• XLogP3: -1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 158.105527694
• Heavy Atom Count: 11
• Complexity: 122

Purity/Quality:

99% ^*data from raw suppliers

4-(2-hydroxyethyl)-1-Piperazinecarboxaldehyde 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CN(CCN1CCO)C=O

Technology Process of 4-(2-Hydroxyethyl)piperazine-1-carbaldehyde

There total 5 articles about 4-(2-Hydroxyethyl)piperazine-1-carbaldehyde 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: 93.0%

1-(2-hydroxyethyl)piperazine (103-76-4) + 5-methyl-2-thioxo-1,3,4-thiadiazole-3(2H)-carbaldehyde (100747-87-3) → 1-Formyl-4-(2-hydroxyethyl)piperazine (25209-64-7)

Guidance literature:

In acetone; at 0 - 5 ℃; for 1h;

DOI:10.1016/S0040-4039(00)89228-X

Reference yield: 91.0%

1-(2-hydroxyethyl)piperazine (103-76-4) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → 1-Formyl-4-(2-hydroxyethyl)piperazine (25209-64-7)

Guidance literature:

With benzoic acid methyl ester; at 200 ℃; for 0.0833333h; Microwave irradiation;

DOI:10.5012/bkcs.2010.31.5.1424

Reference yield:

1-(2-hydroxyethyl)piperazine (103-76-4) + Methyl formate (107-31-3) → 1-Formyl-4-(2-hydroxyethyl)piperazine (25209-64-7)

Guidance literature:

In methanol;

upstream raw materials:

1-(2-hydroxyethyl)piperazine

5-methyl-2-thioxo-1,3,4-thiadiazole-3(2H)-carbaldehyde

Methyl formate

N,N-dimethyl-formamide

Downstream raw materials:

1-[2-(3-cyanophenoxy)ethyl]piperazine

4-(2-(piperazin-1-yl)ethoxy)benzonitrile

2-(2-Cyanophenoxy)ethylpiperazine

4-(2-((1H-benzo[d]imidazol-2-yl)thio)ethyl)piperazine-1-carbaldehyde

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