Cas no 651331-26-9 (1H-Indole-3-decanol, 5-methoxy-)

1H-Indole-3-decanol, 5-methoxy- structure
651331-26-9 structure
Product Name:1H-Indole-3-decanol, 5-methoxy-
CAS No:651331-26-9
MF:C19H29NO2
MW:303.439065694809
CID:405545
PubChem ID:11335698
Update Time:2025-04-19

1H-Indole-3-decanol, 5-methoxy- Chemical and Physical Properties

Names and Identifiers

    • 1H-Indole-3-decanol, 5-methoxy-
    • 10-(5-methoxy-1H-indol-3-yl)decan-1-ol
    • SCHEMBL5368511
    • CHEMBL374565
    • 651331-26-9
    • DTXSID50462790
    • Inchi: 1S/C19H29NO2/c1-22-17-11-12-19-18(14-17)16(15-20-19)10-8-6-4-2-3-5-7-9-13-21/h11-12,14-15,20-21H,2-10,13H2,1H3
    • InChI Key: ZWWKNNFHRKNPKA-UHFFFAOYSA-N
    • SMILES: OCCCCCCCCCCC1=CNC2C=CC(=CC1=2)OC

Computed Properties

  • Exact Mass: 303.21997
  • Monoisotopic Mass: 303.219829168g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 11
  • Complexity: 285
  • 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: 4.8
  • Topological Polar Surface Area: 45.2?2

Experimental Properties

  • PSA: 45.25
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