Cas no 65881-14-3 (2-(5-Methyl-1H-indol-3-yl)acetonitrile)

2-(5-Methyl-1H-indol-3-yl)acetonitrile structure
65881-14-3 structure
Product Name:2-(5-Methyl-1H-indol-3-yl)acetonitrile
CAS No:65881-14-3
MF:C11H10N2
MW:170.210502147675
CID:1032610
PubChem ID:12324170
Update Time:2025-04-20

2-(5-Methyl-1H-indol-3-yl)acetonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-(5-Methyl-1H-indol-3-yl)acetonitrile
    • 65881-14-3
    • (5-Methyl-1H-indol-3-yl)acetonitrile
    • DTXSID20489131
    • 5-METHYLINDOLE-3-ACETONITRILE
    • AKOS012864767
    • SCHEMBL14970013
    • Inchi: 1S/C11H10N2/c1-8-2-3-11-10(6-8)9(4-5-12)7-13-11/h2-3,6-7,13H,4H2,1H3
    • InChI Key: ZENYVKHKRHKWSK-UHFFFAOYSA-N
    • SMILES: N1C=C(CC#N)C2C=C(C)C=CC1=2

Computed Properties

  • Exact Mass: 170.084398327g/mol
  • Monoisotopic Mass: 170.084398327g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 228
  • 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: 2.1
  • Topological Polar Surface Area: 39.6?2

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