Cas no 409315-17-9 (Methanone,1H-imidazol-1-yl-1H-pyrrol-1-yl-)

Methanone,1H-imidazol-1-yl-1H-pyrrol-1-yl- structure
409315-17-9 structure
Product Name:Methanone,1H-imidazol-1-yl-1H-pyrrol-1-yl-
CAS No:409315-17-9
MF:C8H7N3O
MW:161.160681009293
CID:326297
PubChem ID:22952219
Update Time:2025-04-19

Methanone,1H-imidazol-1-yl-1H-pyrrol-1-yl- Chemical and Physical Properties

Names and Identifiers

    • Methanone,1H-imidazol-1-yl-1H-pyrrol-1-yl-
    • 1H-Pyrrole,1-(1H-imidazol-1-ylcarbonyl)-(9CI)
    • SCHEMBL7736262
    • 409315-17-9
    • (1H-Imidazol-1-yl)(1H-pyrrol-1-yl)methanone
    • Inchi: 1S/C8H7N3O/c12-8(10-4-1-2-5-10)11-6-3-9-7-11/h1-7H
    • InChI Key: CRBIQLQIBVOXLG-UHFFFAOYSA-N
    • SMILES: O=C(N1C=NC=C1)N1C=CC=C1

Computed Properties

  • Exact Mass: 161.059
  • Monoisotopic Mass: 161.059
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 177
  • 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: 0.5
  • Topological Polar Surface Area: 39.8A^2
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