Cas no 93362-22-2 (1H-Pyrrole, 3-octadecyl-)

1H-Pyrrole, 3-octadecyl- structure
1H-Pyrrole, 3-octadecyl- structure
Product Name:1H-Pyrrole, 3-octadecyl-
CAS No:93362-22-2
MF:C22H41N
MW:319.567646741867
CID:752731
PubChem ID:14890918
Update Time:2025-04-19

1H-Pyrrole, 3-octadecyl- Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrole, 3-octadecyl-
    • 3-octadecyl-1H-pyrrole
    • 3-octadecyl pyrrole
    • SCHEMBL1532365
    • DTXSID80565026
    • 93362-22-2
    • Inchi: 1S/C22H41N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-19-20-23-21-22/h19-21,23H,2-18H2,1H3
    • InChI Key: GNRWJLDIWSTMMT-UHFFFAOYSA-N
    • SMILES: N1C=CC(=C1)CCCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 319.323900312g/mol
  • Monoisotopic Mass: 319.323900312g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 17
  • Complexity: 226
  • 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: 10.2
  • Topological Polar Surface Area: 15.8?2
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