Cas no 1158-80-1 (3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2))

3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2) structure
1158-80-1 structure
Product Name:3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2)
CAS No:1158-80-1
MF:C16H32Cl4N4
MW:422.264080047607
CID:211843
PubChem ID:3081951
Update Time:2025-10-29

3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2) Chemical and Physical Properties

Names and Identifiers

    • 3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2)
    • spirazidine
    • FT-0682963
    • AKOS005267228
    • 3,12-Bis(2-chloroethyl)-3,6,9,12-tetraazadispiro[5.2.5(9).2(6)]Hexadecane-6,9-diium chloride
    • 1158-80-1
    • CHEMBL447301
    • N,N3-Dichloroethyl-N1,N2-dispirotripiperazine dichloride
    • 3,12-Bis(2-chloroethyl)-3,12-diaza-6,9-diazoniadispiro[5.2.5.2]hexadecane dichloride
    • 3,12-Bis(2-chloroethyl)-3,12-diaza-6,9-diazoniadispiro(5.2.5.2)hexadecane dichloride
    • 51657-49-9
    • 3,12-bis(2-chloroethyl)-3,12-diaza-6,9-diazoniadispiro[5.2.59.26]hexadecane;dichloride
    • 3,12-Diaza-6,9-diazoniadispiro[5.2.5.2]hexadecane,3,12-bis(2-chloroethyl)-, dichloride
    • 3,12-bis(2'-chloroethyl)-3,12-diaza-6,9-diazoniadispiro[5,2,5,2]-hexadecane dichloride
    • 3,12-Diaza-6,9-diazoniadispiro(5.2.5.2)hexadecane, 3,12-bis(2-chloroethyl)-, dichloride
    • Spirazidin
    • N,N(3)-Dichloroethyl-N',N(3)-dispirotripiperazine
    • 3,12-Bis(2-chloroethyl)-3,6,9,12-tetraazadispiro[5.2.5~9~.2~6~]hexadecane-6,9-diium dichloride
    • DTXSID90921811
    • Spirasidin
    • CS-0441338
    • HY-W329824
    • MDL: MFCD18909629
    • Inchi: 1S/C16H32Cl2N4.2ClH/c17-1-3-19-5-9-21(10-6-19)13-15-22(16-14-21)11-7-20(4-2-18)8-12-22;;/h1-16H2;2*1H/q+2;;/p-2
    • InChI Key: OYWCUEAJSZQIEE-UHFFFAOYSA-L
    • SMILES: ClCCN1CC[N+]2(CC1)CC[N+]1(CCN(CCCl)CC1)CC2.[Cl-].[Cl-]

Computed Properties

  • Exact Mass: 422.135
  • Monoisotopic Mass: 420.138
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 4
  • Complexity: 304
  • 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: 6.5?2

Experimental Properties

  • Boiling Point: °Cat760mmHg
  • Flash Point: °C

3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2) Pricemore >>

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3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2) Related Literature

Additional information on 3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2)

3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2) (CAS 1158-80-1): A Comprehensive Technical Overview

The compound 3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2) (CAS 1158-80-1) represents an intriguing class of spirocyclic quaternary ammonium compounds with unique structural features and potential applications. This detailed technical profile explores its chemical characteristics, synthesis pathways, and emerging uses in various fields.

From a structural perspective, this molecule features a distinctive dispiro architecture with four nitrogen atoms incorporated into its framework. The presence of 2-chloroethyl groups at positions 3 and 12 contributes to its reactivity profile, while the quaternary ammonium centers at positions 6 and 9 impart specific physicochemical properties. Researchers have shown growing interest in such multifunctional nitrogen-containing compounds due to their potential in material science and specialty chemical applications.

Recent scientific literature highlights several innovative applications for 3,6,9,12-Tetraazadispiro compounds. In polymer chemistry, these structures serve as potential crosslinking agents or catalytic templates. The compound's unique geometry makes it particularly interesting for developing molecular recognition systems, a hot topic in supramolecular chemistry research. Current studies also explore its potential in creating advanced materials with tailored properties.

The synthesis of CAS 1158-80-1 typically involves multi-step organic transformations, starting from readily available precursors. Modern synthetic approaches emphasize atom economy and green chemistry principles, reflecting the growing demand for sustainable chemical processes. Analytical characterization of this compound requires advanced techniques such as NMR spectroscopy and mass spectrometry to confirm its complex structure.

From a commercial perspective, 3,6,9,12-Tetraazadispiro derivatives have gained attention in specialty chemical markets. The global market for nitrogen-containing heterocycles is projected to grow significantly, driven by demand from pharmaceutical intermediates and advanced material sectors. This compound's unique properties position it as a potential candidate for various high-value applications.

Safety considerations for handling 3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium compounds follow standard laboratory protocols for nitrogen-containing organics. Proper personal protective equipment and ventilation are recommended when working with this chemical. Researchers should consult detailed material safety data for specific handling guidelines.

The future outlook for CAS 1158-80-1 appears promising, with ongoing research exploring novel applications in materials science and chemical synthesis. Its structural complexity offers opportunities for developing next-generation functional materials, particularly in areas requiring precise molecular architectures. As synthetic methodologies advance, we anticipate broader utilization of this interesting compound class.

For researchers investigating spirocyclic nitrogen compounds or quaternary ammonium derivatives, 3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2) presents numerous opportunities for innovation. Its combination of structural features and functional groups makes it a versatile building block for various chemical applications.

Recent patents and publications demonstrate growing interest in modifying the core structure of 3,6,9,12-Tetraazadispiro compounds to achieve specific properties. These developments align with current trends in molecular design and functional material development, addressing industry needs for specialized chemical solutions.

Quality control for CAS 1158-80-1 requires rigorous analytical verification due to its complex structure. Modern analytical laboratories employ advanced techniques including high-resolution mass spectrometry and multidimensional NMR to ensure product purity and confirm structural integrity, meeting the exacting standards of research and industrial applications.

The environmental profile of 3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium derivatives is an active area of investigation, reflecting the chemical industry's focus on green chemistry and sustainable practices. Current research examines biodegradation pathways and potential environmental impacts, contributing to responsible chemical development.

In conclusion, 3,6,9,12-Tetraazadispiro[5.2.5.2]hexadecan-6,9-ium,3,12-bis(2-chloroethyl)-, chloride (1:2) (CAS 1158-80-1) represents a fascinating compound with significant potential across multiple scientific disciplines. Its unique structural features continue to inspire innovative applications in materials science and specialty chemistry, positioning it as a compound of ongoing research interest and commercial potential.

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