Cas no 71565-78-1 ( )

  structure
  structure
Product Name: 
CAS No:71565-78-1
MF:C4H6N2O
MW:98.1032404899597
CID:976581
PubChem ID:231827
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • 2-cyanopropanamide
    • 2-(Methyl)cyanoacetamide
    • 2-cyanopropionamide
    • 2-cyano-propionic acid amide
    • 2-Cyanpropionamid
    • 2-Cyan-propionsaeure-amid
    • 2-methylcyanoacetamide
    • AC1L5MJ5
    • AC1Q4QI9
    • AG-K-61703
    • AR-1E0912
    • CTK5D4660
    • cyanopropylamide
    • NSC28580
    • 2-cyano-methylacetamide
    • 71565-78-1
    • DTXSID70282876
    • methylcyanoacetamide
    • AKOS011118226
    • 2-CYANO-2-METHYLACETAMIDE
    • DASYJICSSLWYAG-UHFFFAOYSA-N
    • 2-Cyano-2-methyl-acetamide
    • EN300-7321993
    • NSC-28580
    • G61799
    •  
    • Inchi: 1S/C4H6N2O/c1-3(2-5)4(6)7/h3H,1H3,(H2,6,7)
    • InChI Key: DASYJICSSLWYAG-UHFFFAOYSA-N
    • SMILES: O=C(C(C#N)C)N

Computed Properties

  • Exact Mass: 98.04808
  • Monoisotopic Mass: 98.048012819g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 1
  • Complexity: 121
  • 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: -0.4
  • Topological Polar Surface Area: 66.9?2

Experimental Properties

  • PSA: 66.88
  • LogP: 0.33168

  Pricemore >>

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