Cas no 412029-30-2 (1H-Indole-4,5-diol (9CI))

1H-Indole-4,5-diol (9CI) structure
1H-Indole-4,5-diol (9CI) structure
Product Name:1H-Indole-4,5-diol (9CI)
CAS No:412029-30-2
MF:C8H7NO2
MW:149.146682024002
CID:1017514
PubChem ID:22023296
Update Time:2025-04-20

1H-Indole-4,5-diol (9CI) Chemical and Physical Properties

Names and Identifiers

    • 1H-Indole-4,5-diol (9CI)
    • 1H-indole-4,5-diol
    • 4,5-dihydroxyindole
    • 1H-Indole-4,5-diol(9ci)
    • AKOS006357476
    • 412029-30-2
    • SCHEMBL1876842
    • DTXSID10621644
    • Inchi： 1S/C8H7NO2/c10-7-2-1-6-5(8(7)11)3-4-9-6/h1-4,9-11H
    • InChI Key： RTTHZDANMGTYSE-UHFFFAOYSA-N
    • SMILES： OC1=C(C=CC2=C1C=CN2)O

Computed Properties

  • Exact Mass: 149.047678466g/mol
  • Monoisotopic Mass: 149.047678466g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 151
  • 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: 1.3
  • Topological Polar Surface Area: 56.2?2

1H-Indole-4,5-diol (9CI) Related Literature

412029-30-2 (1H-Indole-4,5-diol (9CI)) Related Products

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