Cas no 408530-65-4 (2-(2-Oxopyridin-1-yl)acetaldehyde)

2-(2-Oxopyridin-1-yl)acetaldehyde structure
408530-65-4 structure
Product Name:2-(2-Oxopyridin-1-yl)acetaldehyde
CAS No:408530-65-4
MF:C7H7NO2
MW:137.135981798172
CID:926307
Update Time:2023-08-02

2-(2-Oxopyridin-1-yl)acetaldehyde Chemical and Physical Properties

Names and Identifiers

    • 1(2H)-Pyridineacetaldehyde,2-oxo-(9CI)
    • 2-(2-oxopyridin-1-yl)acetaldehyde
    • 1(2h)-pyridineacetaldehyde,2-oxo-
    • 2-(2-Oxopyridin-1-yl)acetaldehyde
    • Inchi: 1S/C7H7NO2/c9-6-5-8-4-2-1-3-7(8)10/h1-4,6H,5H2
    • InChI Key: PBOPSXSISURQPV-UHFFFAOYSA-N
    • SMILES: O=C1C=CC=CN1CC=O

Computed Properties

  • Exact Mass: 137.048
  • Monoisotopic Mass: 137.048
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 206
  • 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: 37.4
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