Cas no 5397-67-1 (Hexahydropyrazolo[1,2-a]pyrazole)

Hexahydropyrazolo[1,2-a]pyrazole is a bicyclic heterocyclic compound featuring a saturated pyrazolo-pyrazole framework. Its rigid, fused-ring structure imparts stability and versatility, making it a valuable scaffold in medicinal chemistry and agrochemical research. The compound’s unique geometry allows for selective functionalization, enabling the development of tailored derivatives with enhanced bioactivity or physicochemical properties. Its high solubility in polar solvents and compatibility with diverse reaction conditions further facilitate its use as an intermediate in synthetic applications. Researchers value Hexahydropyrazolo[1,2-a]pyrazole for its potential in designing novel pharmacophores, particularly in CNS-targeting and anti-inflammatory agents, due to its favorable pharmacokinetic profile.
Hexahydropyrazolo[1,2-a]pyrazole structure
5397-67-1 structure
Product Name:Hexahydropyrazolo[1,2-a]pyrazole
CAS No:5397-67-1
MF:C6H12N2
MW:112.172881126404
CID:372171
PubChem ID:138483
Update Time:2025-05-28

Hexahydropyrazolo[1,2-a]pyrazole Chemical and Physical Properties

Names and Identifiers

    • Hexahydropyrazolo[1,2-a]pyrazole
    • 1,2,3,5,6,7-hexahydropyrazolo[1,2-a]pyrazole
    • 1H,5H-Pyrazolo[1,2-a]pyrazole, tetrahydro-
    • 1,5-diazabicyclo[3,3,0]octane
    • 1,5-diazabicyclo[3.3.0]octan-1-ium
    • 1,5-diazabicyclo[3.3.0]octane
    • AC1L3CWJ
    • NSC4246
    • QC-9219
    • SureCN5909605
    • tetrahydro-pyrazolo[1,2-a]pyrazole
    • 1H,5H-Pyrazolo[1,2-a]pyrazole,tetrahydro-)77DOM/HOU2
    • Tetrahydro-1H,5H-pyrazolo[1,2-a]pyrazole
    • JZRVLNUANYLZKW-UHFFFAOYSA-N
    • 1H,5H-Pyrazolo(1,2-a)pyrazole, tetrahydro-
    • DTXSID00202264
    • 1H,5H-Pyrazolo[1,2-a]pyrazole,tetrahydro-
    • SCHEMBL5909605
    • 5397-67-1
    • NSC 4246
    • NSC-4246
    • 3a,6a-Diazaoctahydropentalene
    • DB-343089
    • Inchi： 1S/C6H12N2/c1-3-7-5-2-6-8(7)4-1/h1-6H2
    • InChI Key： JZRVLNUANYLZKW-UHFFFAOYSA-N
    • SMILES： N12CCCN1CCC2

Computed Properties

  • Exact Mass: 112.10016
  • Monoisotopic Mass: 112.1
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 0
  • Complexity: 72.5
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 6.5A^2
  • XLogP3: 0.8

Experimental Properties

  • Density: 1.08
  • Boiling Point: 155.8°Cat760mmHg
  • Flash Point: 43.9°C
  • Refractive Index: 1.56
  • PSA: 6.48
  • LogP: 0.18860

Hexahydropyrazolo[1,2-a]pyrazole Pricemore >>

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