Cas no 58326-34-4 (Pyrrolo[2,3-b]pyrrole, 1,6-dihydro-)

Pyrrolo[2,3-b]pyrrole, 1,6-dihydro- structure
58326-34-4 structure
Product Name:Pyrrolo[2,3-b]pyrrole, 1,6-dihydro-
CAS No:58326-34-4
MF:C6H6N2
MW:106.125240802765
CID:342487
PubChem ID:55262627
Update Time:2025-04-19

Pyrrolo[2,3-b]pyrrole, 1,6-dihydro- Chemical and Physical Properties

Names and Identifiers

    • Pyrrolo[2,3-b]pyrrole, 1,6-dihydro-
    • 1,6-dihydropyrrolo[2,3-b]pyrrole
    • 58326-34-4
    • DTXSID30717033
    • SCHEMBL2418981
    • AKOS006302746
    • Inchi: 1S/C6H6N2/c1-3-7-6-5(1)2-4-8-6/h1-4,7-8H
    • InChI Key: CGRCTJNCJNTKKL-UHFFFAOYSA-N
    • SMILES: N1C=CC2C=CNC1=2

Computed Properties

  • Exact Mass: 106.05318
  • Monoisotopic Mass: 106.053098200g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 0
  • Complexity: 82.5
  • 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
  • XLogP3: 1.2
  • Topological Polar Surface Area: 31.6?2

Experimental Properties

  • PSA: 31.58
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