Cas no 6631-29-4 (sodium;N'-(benzenesulfonyl)benzohydrazide)

sodium;N'-(benzenesulfonyl)benzohydrazide structure
6631-29-4 structure
Product Name:sodium;N'-(benzenesulfonyl)benzohydrazide
CAS No:6631-29-4
MF:C13H12N2NaO3S
MW:299.300752639771
CID:963665
PubChem ID:54612136
Update Time:2025-04-19

sodium;N'-(benzenesulfonyl)benzohydrazide Chemical and Physical Properties

Names and Identifiers

    • 6631-29-4
    • NSC53081
    • NSC-53081
    • sodium;N'-(benzenesulfonyl)benzohydrazide
    • Inchi: 1S/C13H12N2O3S.Na/c16-13(11-7-3-1-4-8-11)14-15-19(17,18)12-9-5-2-6-10-12;/h1-10,15H,(H,14,16);/q;+1
    • InChI Key: PYPZOLBVWCDWEI-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=CC=1)(NNC(C1C=CC=CC=1)=O)(=O)=O.[Na+]

Computed Properties

  • Exact Mass: 276.05696
  • Monoisotopic Mass: 299.04663270g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 4
  • Complexity: 391
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 83.6?2

Experimental Properties

  • PSA: 80.47
  • LogP: 3.17250

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