Cas no 699-22-9 (1H-Pyrrole, 1-pentyl-)

1H-Pyrrole, 1-pentyl- structure
1H-Pyrrole, 1-pentyl- structure
Product Name:1H-Pyrrole, 1-pentyl-
CAS No:699-22-9
MF:C9H15N
MW:137.222102403641
CID:391135
PubChem ID:557117
Update Time:2025-04-19

1H-Pyrrole, 1-pentyl- Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrole, 1-pentyl-
    • 1-Pentyl-1H-pyrrole
    • 1-pentylpyrrole
    • 1-Amylpyrrole
    • N-Amylpyrrole
    • Pyrrole, 1-pentyl-
    • N-n-pentylpyrrole
    • AKOS008965045
    • N-pentylpyrrole
    • 1-Pentyl-1H-pyrrole #
    • DTXSID40339588
    • 699-22-9
    • UNII-I34JNN5ICH
    • I34JNN5ICH
    • SCHEMBL250676
    • Inchi: 1S/C9H15N/c1-2-3-4-7-10-8-5-6-9-10/h5-6,8-9H,2-4,7H2,1H3
    • InChI Key: VODBTJROPIJKCF-UHFFFAOYSA-N
    • SMILES: N1(C=CC=C1)CCCCC

Computed Properties

  • Exact Mass: 137.12055
  • Monoisotopic Mass: 137.120449483g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 4
  • Complexity: 74.8
  • 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: 2.4
  • Topological Polar Surface Area: 4.9?2

Experimental Properties

  • PSA: 4.93
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