Cas no 52914-17-7 (Benzenamine, N-phenyl-2-(phenylsulfonyl)-)

Benzenamine, N-phenyl-2-(phenylsulfonyl)- structure
52914-17-7 structure
Product Name:Benzenamine, N-phenyl-2-(phenylsulfonyl)-
CAS No:52914-17-7
MF:C18H15NO2S
MW:309.38220334053
CID:358485
PubChem ID:3690887
Update Time:2025-04-19

Benzenamine, N-phenyl-2-(phenylsulfonyl)- Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, N-phenyl-2-(phenylsulfonyl)-
    • 2-(benzenesulfonyl)-N-phenylaniline
    • Oprea1_488434
    • AKOS001145323
    • Z56757376
    • 52914-17-7
    • DTXSID20395102
    • Inchi: 1S/C18H15NO2S/c20-22(21,16-11-5-2-6-12-16)18-14-8-7-13-17(18)19-15-9-3-1-4-10-15/h1-14,19H
    • InChI Key: ZSVKFQDYFLOTJD-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=CC=1)(C1=CC=CC=C1NC1C=CC=CC=1)(=O)=O

Computed Properties

  • Exact Mass: 309.08245
  • Monoisotopic Mass: 309.08234989g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 4
  • Complexity: 431
  • 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: 4.8
  • Topological Polar Surface Area: 54.6?2

Experimental Properties

  • PSA: 46.17
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