Cas no 27884-36-2 (Pyrazino[2,1,6-cd]pyrrolizine(8CI,9CI))

Pyrazino[2,1,6-cd]pyrrolizine(8CI,9CI) structure
27884-36-2 structure
Product Name:Pyrazino[2,1,6-cd]pyrrolizine(8CI,9CI)
CAS No:27884-36-2
MF:C9H6N2
MW:142.157341480255
CID:286923
PubChem ID:141383
Update Time:2025-04-19

Pyrazino[2,1,6-cd]pyrrolizine(8CI,9CI) Chemical and Physical Properties

Names and Identifiers

    • Pyrazino[2,1,6-cd]pyrrolizine(8CI,9CI)
    • Pyrazino(2,1,6-cd)pyrrolizine
    • Pyrazino[2,1,6-cd]pyrrolizine
    • 27884-36-2
    • DTXSID70182180
    • Inchi: 1S/C9H6N2/c1-3-8-5-10-6-9-4-2-7(1)11(8)9/h1-6H
    • InChI Key: OSSKPAOPEGASMO-UHFFFAOYSA-N
    • SMILES: N12C3=CN=CC1=CC=C2C=C3

Computed Properties

  • Exact Mass: 142.05318
  • Monoisotopic Mass: 142.053098200g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 153
  • 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
  • XLogP3: 2.2
  • Topological Polar Surface Area: 17.3?2

Experimental Properties

  • PSA: 17.3

Pyrazino[2,1,6-cd]pyrrolizine(8CI,9CI) Related Literature

  • 1. Heterocyclic compounds with bridgehead nitrogen atoms. Part 7. The synthesis of pyrrolo[2,1,5-cd]indolizines ([2,2,3]cyclazines) and pyrazino[2,1,6-cd]pyrrolizines (6-aza[2,2,3]cyclazines) from 3H-pyrrolizine
    Michael A. Jessep,Derek Leaver J. Chem. Soc. Perkin Trans. 1 1980 1319
  • 2. Pyrazino[2,1,6-cd:5,4,3-c′d′]dipyrrolizine: a doubly bridged [14]annulene of cyclazine type
    Derek Leaver,David Skinner J. Chem. Soc. Chem. Commun. 1984 821
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