Cas no 90094-15-8 (1-Naphthalenesulfonic acid, 8-[(phenylmethylene)amino]-)

1-Naphthalenesulfonic acid, 8-[(phenylmethylene)amino]- structure
90094-15-8 structure
Product Name:1-Naphthalenesulfonic acid, 8-[(phenylmethylene)amino]-
CAS No:90094-15-8
MF:C17H13NO3S
MW:311.355023145676
CID:794510
PubChem ID:71430396
Update Time:2025-04-19

1-Naphthalenesulfonic acid, 8-[(phenylmethylene)amino]- Chemical and Physical Properties

Names and Identifiers

    • 1-Naphthalenesulfonic acid, 8-[(phenylmethylene)amino]-
    • 8-(benzylideneamino)naphthalene-1-sulfonic acid
    • 8-[(E)-Benzylideneamino]naphthalene-1-sulfonic acid
    • DTXSID30849020
    • 90094-15-8
    • Inchi: 1S/C17H13NO3S/c19-22(20,21)16-11-5-9-14-8-4-10-15(17(14)16)18-12-13-6-2-1-3-7-13/h1-12H,(H,19,20,21)/b18-12+
    • InChI Key: CGXUEHWVXRJRJZ-LDADJPATSA-N
    • SMILES: S(C1C=CC=C2C=CC=C(C2=1)/N=C/C1C=CC=CC=1)(=O)(=O)O

Computed Properties

  • Exact Mass: 311.06161445g/mol
  • Monoisotopic Mass: 311.06161445g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 3
  • Complexity: 491
  • 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: 3.2
  • Topological Polar Surface Area: 75.1?2
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