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2,5,7-triazaspiro[3.4]octane-6,8-dione hydrochloride

  • CAS No. 1026796-27-9

  • Cat. No. CS-0055607
  • Molecule weight177.59
  • Purity≥97%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

2,5,7-triazaspiro[3.4]octane-6,8-dione hydrochloride|CS-0055607

Structure of 1026796-27-9

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General Information

  • CAS No. 1026796-27-9
  • Cat. No. CS-0055607
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₈ClN₃O₂
  • Molecular Weight 177.59
  • Synonym(s) None
  • SMILES O=C(NC1=O)NC21CNC2.[H]Cl

Description

This hydrochloride salt features a rigid, electron-deficient triazaspiro scaffold that enhances solubility and stability under standard conditions. The dione functionality enables direct incorporation into synthetic sequences requiring polar, hydrogen-bonding motifs. Its bench-stable nature supports straightforward handling in process development workflows.

Application

2,5,7-Triazaspiro[3.4]octane-6,8-dione hydrochloride serves as a rigid, nitrogen-rich heterocyclic scaffold enabling efficient access to spirocyclic intermediates in medicinal chemistry. Its stable, crystalline form facilitates handling and purification, while the protected diketone functionality tolerates diverse transformations. The molecule functions as a key building block for targeted synthesis of bioactive compounds, particularly those requiring constrained geometries and enhanced solubility in drug discovery workflows.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   70.23
  • LogP   -1.4104
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   0

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