Cas no 287472-25-7 (5-Pyrimidineacetonitrile,a-amino-)

5-Pyrimidineacetonitrile,a-amino- structure
287472-25-7 structure
Product Name:5-Pyrimidineacetonitrile,a-amino-
CAS No:287472-25-7
MF:C6H6N4
MW:134.13863992691
CID:248743
PubChem ID:20080448
Update Time:2025-04-19

5-Pyrimidineacetonitrile,a-amino- Chemical and Physical Properties

Names and Identifiers

    • 5-Pyrimidineacetonitrile,a-amino-
    • 5-Pyrimidineacetonitrile, alpha-amino- (9CI)
    • 2-amino-2-pyrimidin-5-ylacetonitrile
    • DTXSID701301260
    • 2-amino-2-(pyrimidin-5-yl)acetonitrile
    • Amino(pyrimidin-5-yl)acetonitrile
    • alpha-Amino-5-pyrimidineacetonitrile
    • 287472-25-7
    • Amino (pyrimidin-5-yl)acetonitrile
    • SCHEMBL8305141
    • AKOS006337620
    • YGRHTKCWNUWRLG-UHFFFAOYSA-N
    • Inchi: 1S/C6H6N4/c7-1-6(8)5-2-9-4-10-3-5/h2-4,6H,8H2
    • InChI Key: YGRHTKCWNUWRLG-UHFFFAOYSA-N
    • SMILES: NC(C#N)C1=CN=CN=C1

Computed Properties

  • Exact Mass: 134.059246208g/mol
  • Monoisotopic Mass: 134.059246208g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 141
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1
  • Topological Polar Surface Area: 75.6?2
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