Cas no 68282-48-4 (2-propyl-1H-Imidazole-5-carboxaldehyde)

2-propyl-1H-Imidazole-5-carboxaldehyde structure
68282-48-4 structure
Product Name:2-propyl-1H-Imidazole-5-carboxaldehyde
CAS No:68282-48-4
MF:C7H10N2O
MW:138.167101383209
CID:969868
PubChem ID:11083952
Update Time:2025-04-19

2-propyl-1H-Imidazole-5-carboxaldehyde Chemical and Physical Properties

Names and Identifiers

    • 2-propyl-1H-Imidazole-5-carboxaldehyde
    • 2-propyl-1H-imidazole-5-carbaldehyde
    • 2-PROPYL-5-FORMYLIMIDAZOLE
    • 2-n-Propyl-4-imidazolecarboxaldehyde
    • SCHEMBL7493066
    • 68282-48-4
    • RJJUHCRCATVRBK-UHFFFAOYSA-N
    • 2-propyl-1H-imidazole-4-carbaldehyde
    • AKOS013432034
    • SCHEMBL11306926
    • DTXSID30454532
    • Inchi: 1S/C7H10N2O/c1-2-3-7-8-4-6(5-10)9-7/h4-5H,2-3H2,1H3,(H,8,9)
    • InChI Key: RJJUHCRCATVRBK-UHFFFAOYSA-N
    • SMILES: O=CC1=CN=C(CCC)N1

Computed Properties

  • Exact Mass: 138.079312947g/mol
  • Monoisotopic Mass: 138.079312947g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 3
  • Complexity: 116
  • 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: 1
  • Topological Polar Surface Area: 45.8?2
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