Cas no 1192307-72-4 (1-ethyl-1H-Imidazole-5-carbonitrile)

1-ethyl-1H-Imidazole-5-carbonitrile structure
1192307-72-4 structure
Product Name:1-ethyl-1H-Imidazole-5-carbonitrile
CAS No:1192307-72-4
MF:C6H7N3
MW:121.139880418777
CID:1101209
PubChem ID:66132756
Update Time:2025-04-20

1-ethyl-1H-Imidazole-5-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 1-ethyl-1H-Imidazole-5-carbonitrile
    • AKOS015475705
    • MFCD21336062
    • 1192307-72-4
    • SCHEMBL23139104
    • SY350346
    • Inchi: 1S/C6H7N3/c1-2-9-5-8-4-6(9)3-7/h4-5H,2H2,1H3
    • InChI Key: FVTZMXXRQCCNLP-UHFFFAOYSA-N
    • SMILES: N1(C=NC=C1C#N)CC

Computed Properties

  • Exact Mass: 121.063997236g/mol
  • Monoisotopic Mass: 121.063997236g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 135
  • 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: 0.4
  • Topological Polar Surface Area: 41.6?2
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