Cas no 88963-86-4 (1-Naphthalenesulfonyl chloride, 5-[[2-(acetylamino)ethyl]amino]-)

1-Naphthalenesulfonyl chloride, 5-[[2-(acetylamino)ethyl]amino]- structure
88963-86-4 structure
Product Name:1-Naphthalenesulfonyl chloride, 5-[[2-(acetylamino)ethyl]amino]-
CAS No:88963-86-4
MF:C14H15ClN2O3S
MW:326.798501253128
CID:617940
PubChem ID:58907729
Update Time:2025-04-19

1-Naphthalenesulfonyl chloride, 5-[[2-(acetylamino)ethyl]amino]- Chemical and Physical Properties

Names and Identifiers

    • 1-Naphthalenesulfonyl chloride, 5-[[2-(acetylamino)ethyl]amino]-
    • 5-(2-acetamidoethylamino)naphthalene-1-sulfonyl chloride
    • 88963-86-4
    • 5-[(2-Acetamidoethyl)amino]naphthalene-1-sulfonyl chloride
    • DTXSID10730563
    • SCHEMBL14174460
    • Inchi: 1S/C14H15ClN2O3S/c1-10(18)16-8-9-17-13-6-2-5-12-11(13)4-3-7-14(12)21(15,19)20/h2-7,17H,8-9H2,1H3,(H,16,18)
    • InChI Key: YYMWWYNVWXLXHA-UHFFFAOYSA-N
    • SMILES: ClS(C1=CC=CC2=C(C=CC=C21)NCCNC(C)=O)(=O)=O

Computed Properties

  • Exact Mass: 326.0491912g/mol
  • Monoisotopic Mass: 326.0491912g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 5
  • Complexity: 463
  • 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: 2.5
  • Topological Polar Surface Area: 83.6?2
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