Cas no 754123-09-6 (5-methyl-3H-indol-2-amine)

5-methyl-3H-indol-2-amine structure
5-methyl-3H-indol-2-amine structure
Product Name:5-methyl-3H-indol-2-amine
CAS No:754123-09-6
MF:C9H10N2
MW:146.189101696014
MDL:MFCD19208239
CID:561871
PubChem ID:45078926
Update Time:2025-04-19

5-methyl-3H-indol-2-amine Chemical and Physical Properties

Names and Identifiers

    • 3H-Indol-2-amine,5-methyl-
    • 3H-Indol-2-amine,5-methyl-(9CI)
    • 5-methyl-3H-indol-2-amine
    • MDL: MFCD19208239
    • Inchi: 1S/C9H10N2/c1-6-2-3-8-7(4-6)5-9(10)11-8/h2-4H,5H2,1H3,(H2,10,11)
    • InChI Key: OBBHOLGTEYOYPJ-UHFFFAOYSA-N
    • SMILES: N1=C(CC2C=C(C)C=CC1=2)N

Computed Properties

  • Exact Mass: 146.0845
  • Monoisotopic Mass: 146.084
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 186
  • 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: 38.4A^2
  • XLogP3: 0.8

Experimental Properties

  • PSA: 38.38

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