Cas no 921-76-6 (Propanedinitrile, (1-aminoethylidene)-)

Propanedinitrile, (1-aminoethylidene)- structure
921-76-6 structure
Product Name:Propanedinitrile, (1-aminoethylidene)-
CAS No:921-76-6
MF:C5H5N3
MW:107.113300085068
CID:754322
PubChem ID:12525758
Update Time:2025-04-19

Propanedinitrile, (1-aminoethylidene)- Chemical and Physical Properties

Names and Identifiers

    • 2-(1-aminoethylidene)propanedinitrile
    • Propanedinitrile, (1-aminoethylidene)-
    • SCHEMBL10644863
    • RARBUZWPZHQBHW-UHFFFAOYSA-N
    • AKOS006339548
    • 3-amino-2-cyanocrotononitrile
    • 921-76-6
    • (1-Aminoethylidene)propanedinitrile
    • DTXSID30501358
    • Inchi: 1S/C5H5N3/c1-4(8)5(2-6)3-7/h8H2,1H3
    • InChI Key: RARBUZWPZHQBHW-UHFFFAOYSA-N
    • SMILES: N/C(=C(\C#N)/C#N)/C

Computed Properties

  • Exact Mass: 107.048347172g/mol
  • Monoisotopic Mass: 107.048347172g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 0
  • Complexity: 188
  • 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: -0.2
  • Topological Polar Surface Area: 73.6?2

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