Cas no 128200-38-4 (5-methoxy-1-methyl-1H-Indole-3-carbonitrile)

5-methoxy-1-methyl-1H-Indole-3-carbonitrile structure
128200-38-4 structure
Product Name:5-methoxy-1-methyl-1H-Indole-3-carbonitrile
CAS No:128200-38-4
MF:C11H10N2O
MW:186.20990228653
CID:1104021
PubChem ID:91605366
Update Time:2025-04-20

5-methoxy-1-methyl-1H-Indole-3-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 5-methoxy-1-methyl-1H-Indole-3-carbonitrile
    • 128200-38-4
    • DA-20706
    • SCHEMBL18365442
    • Inchi: 1S/C11H10N2O/c1-13-7-8(6-12)10-5-9(14-2)3-4-11(10)13/h3-5,7H,1-2H3
    • InChI Key: OIPMMVPDCMQPEK-UHFFFAOYSA-N
    • SMILES: COC1C=C2C(N(C=C2C#N)C)=CC=1

Computed Properties

  • Exact Mass: 186.079312947g/mol
  • Monoisotopic Mass: 186.079312947g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 257
  • 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
  • Topological Polar Surface Area: 38?2
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