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CS-W001157 4
Total: USD 88.00

2,3,5,6,7,8-Hexahydrophthalazine-1,4-dione

  • CAS No. 67279-23-6

  • Cat. No. CS-0155302
  • Molecule weight166.18
  • Purity≥98%
  • MDL No.MFCD27927305

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

2,3,5,6,7,8-Hexahydrophthalazine-1,4-dione|CS-0155302

Structure of 67279-23-6

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General Information

  • CAS No. 67279-23-6
  • Cat. No. CS-0155302
  • Purity ≥98%
  • MDL No. MFCD27927305
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀N₂O₂
  • Molecular Weight 166.18
  • Synonym(s) None
  • SMILES O=C1NNC(C2=C1CCCC2)=O

Description

This hexahydrophthalazine-1,4-dione derivative features a saturated heterocyclic core with two carbonyl groups in conjugation, enabling its use as a stable, electron-deficient scaffold in synthetic routes. Its bench-stable nature and compatibility with diverse reaction conditions support efficient incorporation into complex molecular architectures.

Application

2,3,5,6,7,8-Hexahydrophthalazine-1,4-dione serves as a versatile scaffold for the synthesis of heterocyclic compounds and bioactive molecules. Its saturated ring system offers enhanced stability and favorable solubility profiles, enabling efficient functionalization at multiple positions. The dione functionality facilitates nucleophilic addition and condensation reactions, making it a practical building block for medicinal chemistry campaigns and process-scale applications.

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   65.72
  • LogP   -0.058
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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