Cas no 53502-60-6 (Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2))

Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2) is a hydrochloride salt derivative of 1-(2-chloroethyl)piperazine, commonly utilized as an intermediate in organic synthesis and pharmaceutical research. The compound features a reactive chloroethyl group attached to the piperazine ring, enabling its use in alkylation reactions and the preparation of more complex molecules. Its high purity and stability in solid form make it suitable for controlled synthetic applications. The hydrochloride salt form enhances solubility in polar solvents, facilitating its incorporation into aqueous reaction systems. This compound is particularly valuable in medicinal chemistry for the development of bioactive molecules, including potential therapeutic agents targeting neurological and cardiovascular systems.
Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2) structure
53502-60-6 structure
Product Name:Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2)
CAS No:53502-60-6
MF:C6H14Cl2N2
MW:185.094759464264
MDL:MFCD12031816
CID:380337
PubChem ID:11332881
Update Time:2025-10-29

Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2) Chemical and Physical Properties

Names and Identifiers

    • Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2)
    • 1-(2-chloroethyl)piperazine
    • 1-(2-chloroethyl)-piperazine dihydrochloride
    • 1-(2-chloroethyl)piperazine,hydrochloride
    • Chloroethylpiperazine
    • N-Piperazinoethylchlorid
    • 1-(2-chloroethyl)piperazine;hydrochloride
    • 1-(2-Chloroethyl)piperazinexhydrochloride
    • 1-(2-chloroethyl)piperazine hcl
    • SCHEMBL6482678
    • DTXSID50968242
    • NSC-91945
    • 1-(2-Chloroethyl)piperazine xhydrochloride
    • CS-0363384
    • BS-28888
    • 1-(2-chloroethyl)piperazinedihydrochloride
    • 53502-60-6
    • NSC91945
    • 75256-75-6
    • 1-(2-chloroethyl)piperazine Hydrochloride
    • 1-(2-Chloroethyl)piperazine--hydrogen chloride (1/1)
    • 54267-47-9
    • MDL: MFCD12031816
    • Inchi: 1S/C6H13ClN2.ClH/c7-1-4-9-5-2-8-3-6-9;/h8H,1-6H2;1H
    • InChI Key: XIBJAEUNYGEDAU-UHFFFAOYSA-N
    • SMILES: ClCCN1CCNCC1.Cl

Computed Properties

  • Exact Mass: 184.05300
  • Monoisotopic Mass: 220.03
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 71.5
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 15.3A^2

Experimental Properties

  • Density: 1.042
  • Boiling Point: 222.4°C at 760 mmHg
  • Flash Point: 88.3°C
  • Refractive Index: 1.466
  • PSA: 15.27000
  • LogP: 1.19910

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Additional information on Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2)

Piperazine,1-(2-chloroethyl)-, Hydrochloride (1:2): A Comprehensive Overview

Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2), also known by its CAS number 53502-60-6, is a chemical compound that has garnered significant attention in various scientific and industrial applications. This compound belongs to the class of piperazines, which are six-membered ring structures containing two nitrogen atoms. The presence of a chloroethyl group at the 1-position of the piperazine ring introduces unique chemical properties, making it a versatile molecule for diverse uses.

The structural formula of Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2) consists of a piperazine ring with a chloroethyl substituent and a hydrochloride counterion in a 1:2 molar ratio. This configuration not only enhances its stability but also influences its reactivity in different chemical environments. Recent studies have highlighted the importance of such structural features in determining the compound's behavior in pharmaceutical and material science applications.

One of the most notable applications of Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2) is in the field of drug discovery. Researchers have explored its potential as a building block for developing bioactive molecules with specific pharmacological properties. For instance, its ability to form stable complexes with metal ions has been leveraged in designing drugs targeting metalloenzymes and metalloproteins. This research is particularly relevant given the increasing interest in metal-based therapies for diseases such as cancer and neurodegenerative disorders.

In addition to its pharmaceutical applications, Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2) has found utility in materials science. Its unique electronic properties make it a candidate for use in organic electronics and advanced materials such as conductive polymers and self-healing materials. Recent advancements in this area have demonstrated how modifying the piperazine structure can significantly enhance the performance of these materials under various conditions.

The synthesis of Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2) involves a series of well-established organic reactions, including nucleophilic substitution and acid-base neutralization. These methods ensure high purity and scalability, which are critical for both laboratory research and industrial production. Innovations in green chemistry have also led to more sustainable synthesis pathways for this compound, reducing environmental impact while maintaining product quality.

From an environmental perspective, understanding the fate and transport of Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2) in natural systems is essential for assessing its potential ecological risks. Studies have shown that this compound undergoes biodegradation under specific conditions, which is promising for its safe disposal and minimizing contamination risks.

In conclusion, Piperazine,1-(2-chloroethyl)-, hydrochloride (1:2) is a multifaceted compound with significant implications across various scientific disciplines. Its structural versatility and unique chemical properties continue to drive innovative research and development across industries. As advancements in chemistry and materials science unfold, this compound is poised to play an even more critical role in shaping future technologies and therapeutic solutions.

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