Cas no 19606-13-4 (5-Pyrimidinecarboxaldehyde,2-amino-4-methyl-)

5-Pyrimidinecarboxaldehyde,2-amino-4-methyl- structure
19606-13-4 structure
Product Name:5-Pyrimidinecarboxaldehyde,2-amino-4-methyl-
CAS No:19606-13-4
MF:C6H7N3O
MW:137.139280557632
CID:123680
PubChem ID:45080440
Update Time:2025-04-18

5-Pyrimidinecarboxaldehyde,2-amino-4-methyl- Chemical and Physical Properties

Names and Identifiers

    • 5-Pyrimidinecarboxaldehyde,2-amino-4-methyl-
    • 2-amino-4-methylpyrimidine-5-carbaldehyde
    • 5-Pyrimidinecarboxaldehyde, 2-amino-4-methyl- (8CI)
    • 19606-13-4
    • SCHEMBL14320248
    • Inchi: 1S/C6H7N3O/c1-4-5(3-10)2-8-6(7)9-4/h2-3H,1H3,(H2,7,8,9)
    • InChI Key: GQJUWXJAKXOBCW-UHFFFAOYSA-N
    • SMILES: O=CC1=CN=C(N)N=C1C

Computed Properties

  • Exact Mass: 137.05901
  • Monoisotopic Mass: 137.059
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 128
  • 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
  • Topological Polar Surface Area: 68.9A^2
  • XLogP3: -0.3

Experimental Properties

  • PSA: 68.87
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