Cas no 63196-29-2 (3,5-Pyridinedicarbonitrile, 2,6-diamino-)

3,5-Pyridinedicarbonitrile,  2,6-diamino- structure
63196-29-2 structure
Product Name:3,5-Pyridinedicarbonitrile, 2,6-diamino-
CAS No:63196-29-2
MF:C7H5N5
MW:159.148099660873
CID:959141
PubChem ID:377555
Update Time:2025-04-19

3,5-Pyridinedicarbonitrile, 2,6-diamino- Chemical and Physical Properties

Names and Identifiers

    • 3,5-Pyridinedicarbonitrile, 2,6-diamino-
    • 2,6-Diamino-3,5-pyridinedicarbonitrile
    • 2,6-diamino-3,5-dicyano-4-phenyl-4H-thiopyran
    • 2,6-diamino-3,5-dicyano-4-phenylthiopyran
    • 2,6-diamino-3,5-dicyanopyridine
    • 2,6-diamino-4-phenyl-3,5-dicyano-4H-thiopyran
    • 2,6-Diamino-pyridin-3,5-dicarbonitril
    • 2,6-diaminopyridine-3,5-dicarbonitrile
    • 2,6-diamino-pyridine-3,5-dicarbonitrile
    • AC1LENT3
    • CCG-55521
    • HMS1432H18
    • Maybridge3_000524
    • RSC002076
    • RSCBB000780
    • STOCK1S-21735
    • DB-324380
    • NSC-659122
    • NCI60_020796
    • 63196-29-2
    • CHEMBL1970144
    • NSC659122
    • 3,5-Pyridinedicarbonitrile, 2,6-diamino-
    • Inchi: 1S/C7H5N5/c8-2-4-1-5(3-9)7(11)12-6(4)10/h1H,(H4,10,11,12)
    • InChI Key: JSKRRQDSARSJTR-UHFFFAOYSA-N
    • SMILES: N1C(=C(C#N)C=C(C#N)C=1N)N

Computed Properties

  • Exact Mass: 159.05465
  • Monoisotopic Mass: 159.05449518g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 230
  • 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: 0.7
  • Topological Polar Surface Area: 113?2

Experimental Properties

  • PSA: 112.51
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