Cas no 309976-26-9 (1H-Indole-7-carboxaldehyde,5-methyl-)

1H-Indole-7-carboxaldehyde,5-methyl- structure
309976-26-9 structure
Product Name:1H-Indole-7-carboxaldehyde,5-methyl-
CAS No:309976-26-9
MF:C10H9NO
MW:159.184562444687
CID:300657
PubChem ID:17985409
Update Time:2025-04-19

1H-Indole-7-carboxaldehyde,5-methyl- Chemical and Physical Properties

Names and Identifiers

    • 1H-Indole-7-carboxaldehyde,5-methyl-
    • 5-methyl-1H-Indole-7-carboxaldehyde
    • 5-Methylindole-7-carboxaldehyde
    • FT-0738760
    • 5-Methyl-1H-indole-7-carbaldehyde
    • SCHEMBL2264767
    • 309976-26-9
    • WMGXNQSECQTVMV-UHFFFAOYSA-N
    • Inchi: 1S/C10H9NO/c1-7-4-8-2-3-11-10(8)9(5-7)6-12/h2-6,11H,1H3
    • InChI Key: WMGXNQSECQTVMV-UHFFFAOYSA-N
    • SMILES: O=CC1=CC(C)=CC2C=CNC=21

Computed Properties

  • Exact Mass: 159.06847
  • Monoisotopic Mass: 159.068
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 181
  • 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
  • Topological Polar Surface Area: 32.9A^2
  • XLogP3: 1.9

Experimental Properties

  • PSA: 32.86

1H-Indole-7-carboxaldehyde,5-methyl- Related Literature

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