Cas no 24522-46-1 (Acetamide,2-cyano-N-(2,4,5-trimethylphenyl)-)

Acetamide,2-cyano-N-(2,4,5-trimethylphenyl)- structure
24522-46-1 structure
Product Name:Acetamide,2-cyano-N-(2,4,5-trimethylphenyl)-
CAS No:24522-46-1
MF:C12H14N2O
MW:202.252362728119
CID:259971
PubChem ID:308070
Update Time:2025-04-19

Acetamide,2-cyano-N-(2,4,5-trimethylphenyl)- Chemical and Physical Properties

Names and Identifiers

    • Acetamide,2-cyano-N-(2,4,5-trimethylphenyl)-
    • 2-cyano-N-(2,4,5-trimethylphenyl)acetamide
    • AC1L7C4Q
    • DP00098
    • MolPort-002-897-529
    • N1-(2,4,5-trimethylphenyl)-2-cyanoacetamide
    • NSC207853
    • NSC-207853
    • Oprea1_251011
    • 24522-46-1
    • DTXSID10308701
    • Inchi: 1S/C12H14N2O/c1-8-6-10(3)11(7-9(8)2)14-12(15)4-5-13/h6-7H,4H2,1-3H3,(H,14,15)
    • InChI Key: ODDQVQHAOCKNJE-UHFFFAOYSA-N
    • SMILES: O=C(CC#N)NC1C=C(C)C(C)=CC=1C

Computed Properties

  • Exact Mass: 202.11072
  • Monoisotopic Mass: 202.110613074g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 279
  • 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: 2.6
  • Topological Polar Surface Area: 52.9?2

Experimental Properties

  • PSA: 52.89
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