Cas no 91880-64-7 (N-[4-(Aziridine-1-sulfonyl)phenyl]acetamide)

N-[4-(Aziridine-1-sulfonyl)phenyl]acetamide structure
91880-64-7 structure
Product Name:N-[4-(Aziridine-1-sulfonyl)phenyl]acetamide
CAS No:91880-64-7
MF:C10H12N2O3S
MW:240.278881072998
CID:997594
PubChem ID:311958
Update Time:2025-04-20

N-[4-(Aziridine-1-sulfonyl)phenyl]acetamide Chemical and Physical Properties

Names and Identifiers

    • N-[4-(aziridin-1-ylsulfonyl)phenyl]acetamide
    • NSC-219867
    • N-[4-(Aziridine-1-sulfonyl)phenyl]acetamide
    • DTXSID80309922
    • NSC219867
    • 91880-64-7
    • Inchi: 1S/C10H12N2O3S/c1-8(13)11-9-2-4-10(5-3-9)16(14,15)12-6-7-12/h2-5H,6-7H2,1H3,(H,11,13)
    • InChI Key: DFOXZEONQGWNBX-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(=CC=1)NC(C)=O)(N1CC1)(=O)=O

Computed Properties

  • Exact Mass: 240.05686342g/mol
  • Monoisotopic Mass: 240.05686342g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 362
  • 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: 0.3
  • Topological Polar Surface Area: 74.6?2
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