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(9aS)-1,6,7,8,9,9a-Hexahydropyrazino[2,1-c][1,4]oxazin-4-one hydrochloride

  • CAS No. 1383427-98-2

  • Cat. No. CS-0185255
  • Purity≥95%
  • MDL No.MFCD30470764

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

(9aS)-1,6,7,8,9,9a-Hexahydropyrazino[2,1-c][1,4]oxazin-4-one hydrochloride|CS-0185255

Structure of 1383427-98-2

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General Information

  • CAS No. 1383427-98-2
  • Cat. No. CS-0185255
  • Purity ≥95%
  • MDL No. MFCD30470764
  • Storage Store at room temperature, keep dry and cool
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₃ClN₂O₂
  • Molecular Weight 192.64
  • Synonym(s) (S)-hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
  • SMILES O=C1N2[C@]([H])(COC1)CNCC2.[H]Cl

Description

This hexahydropyrazino[2,1-c][1,4]oxazinone hydrochloride features a rigid, electron-deficient heterocyclic core that integrates seamlessly into complex molecular architectures. Its bench-stable crystalline form facilitates handling in synthetic workflows, enabling efficient incorporation into bioactive scaffolds and medicinal chemistry campaigns.

Application

(9aS)-1,6,7,8,9,9a-Hexahydropyrazino[2,1-c][1,4]oxazin-4-one hydrochloride serves as a versatile chiral building block in medicinal chemistry, enabling efficient access to complex heterocyclic scaffolds. Its rigid, defined stereochemistry and functional group tolerance facilitate reliable coupling reactions and downstream derivatization. The hydrochloride salt enhances solubility and stability for handling, making it well-suited for parallel synthesis and process development 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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   41.57
  • LogP   -0.7612
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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