Cas no 59529-21-4 (N-Pentylindole)

N-Pentylindole structure
N-Pentylindole structure
Product Name:N-Pentylindole
CAS No:59529-21-4
MF:C13H17N
MW:187.280783414841
MDL:MFCD00963300
CID:338353
PubChem ID:3454683
Update Time:2025-07-30

N-Pentylindole Chemical and Physical Properties

Names and Identifiers

    • 1-Pentyl-1H-indole
    • N-Pentylindole
    • 1H-Indole, 1-pentyl-
    • 1-pentylindole
    • QWLCOOAYMQWDPR-UHFFFAOYSA-N
    • pentyl 1h indol
    • 8859AB
    • AX8250723
    • ST24038164
    • 10.14272/QWLCOOAYMQWDPR-UHFFFAOYSA-N.1
    • doi:10.14272/QWLCOOAYMQWDPR-UHFFFAOYSA-N.1
    • NS00067983
    • A869181
    • F30118
    • Q-200131
    • AKOS013124339
    • 59529-21-4
    • DTXSID90392628
    • AS-48268
    • CS-0152134
    • MFCD00963300
    • FT-0673614
    • SY240768
    • SCHEMBL4554026
    • 1-Pentylindole; 1-Pentyl-1H-indole
    • XH1421
    • DB-337373
    • MDL: MFCD00963300
    • Inchi: 1S/C13H17N/c1-2-3-6-10-14-11-9-12-7-4-5-8-13(12)14/h4-5,7-9,11H,2-3,6,10H2,1H3
    • InChI Key: QWLCOOAYMQWDPR-UHFFFAOYSA-N
    • SMILES: N1(C=CC2C=CC=CC1=2)CCCCC

Computed Properties

  • Exact Mass: 187.13621
  • Monoisotopic Mass: 187.136099547g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 167
  • 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: 4.4
  • Topological Polar Surface Area: 4.9

Experimental Properties

  • PSA: 4.93

N-Pentylindole Pricemore >>

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