Cas no 53807-36-6 (N,N-Dibutyl-2-cyanoacetamide)

N,N-Dibutyl-2-cyanoacetamide structure
N,N-Dibutyl-2-cyanoacetamide structure
Product Name:N,N-Dibutyl-2-cyanoacetamide
CAS No:53807-36-6
MF:C11H20N2O
MW:196.289302825928
CID:2830928
PubChem ID:28983259
Update Time:2025-04-21

N,N-Dibutyl-2-cyanoacetamide Chemical and Physical Properties

Names and Identifiers

    • DTXSID90651883
    • N,N-DIBUTYL-2-CYANOACETAMIDE
    • SCHEMBL1962379
    • 53807-36-6
    • N,N-Dibutyl-2-cyanoacetamide
    • Inchi: 1S/C11H20N2O/c1-3-5-9-13(10-6-4-2)11(14)7-8-12/h3-7,9-10H2,1-2H3
    • InChI Key: CQPQBICYNIUIIF-UHFFFAOYSA-N
    • SMILES: O=C(CC#N)N(CCCC)CCCC

Computed Properties

  • Exact Mass: 196.157563266Da
  • Monoisotopic Mass: 196.157563266Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 7
  • Complexity: 197
  • 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: 2.1
  • Topological Polar Surface Area: 44.1?2
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