Cas no 5698-56-6 (Benzoic acid,4-[(dichloroamino)sulfonyl]-, sodium salt (1:1))

Benzoic acid,4-[(dichloroamino)sulfonyl]-, sodium salt (1:1) structure
5698-56-6 structure
Product Name:Benzoic acid,4-[(dichloroamino)sulfonyl]-, sodium salt (1:1)
CAS No:5698-56-6
MF:C7H4Cl2NNaO4S
MW:292.071729660034
CID:374310
PubChem ID:23677888
Update Time:2025-04-19

Benzoic acid,4-[(dichloroamino)sulfonyl]-, sodium salt (1:1) Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,4-[(dichloroamino)sulfonyl]-, sodium salt (1:1)
    • Dichlorosulfamidobenzoic acid
    • sodium 4-[(dichloroamino)sulphonyl]benzoate
    • Pantosept
    • NSC 163513
    • NS00082257
    • CHEMBL1762664
    • Sodium 4-((dichloroamino)sulphonyl)benzoate
    • Q27286820
    • UNII-PZE672762W
    • SODIUM 4-[(DICHLOROAMINO)SULFONYL]BENZOATE
    • Benzoic acid, p-(dichlorosulfamoyl)-, sodium salt
    • PANTOCID-SODIUM
    • Sodium 4-(N,N-Dichlorosulfamoyl)Benzoate
    • 5698-56-6
    • BENZOIC ACID, 4-((DICHLOROAMINO)SULFONYL)-, SODIUM SALT (1:1)
    • PZE672762W
    • SODIUM P-DICHLOROSULFAMIDOBENZOATE
    • BENZOIC ACID, 4-((DICHLOROAMINO)SULFONYL)-, SODIUM SALT
    • NSC-163513
    • AKOS024332200
    • EINECS 227-176-3
    • Halazone sodium
    • Inchi: 1S/C7H5Cl2NO4S.Na/c8-10(9)15(13,14)6-3-1-5(2-4-6)7(11)12;/h1-4H,(H,11,12);/q;+1/p-1
    • InChI Key: QTHWRGNWAMGOMB-UHFFFAOYSA-M
    • SMILES: ClN(S(C1C=CC(C(=O)[O-])=CC=1)(=O)=O)Cl.[Na+]

Computed Properties

  • Exact Mass: 291.92100
  • Monoisotopic Mass: 290.914
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 335
  • 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: 85.9A^2

Experimental Properties

  • Density: 1.717
  • Boiling Point: 437°Cat760mmHg
  • Flash Point: 218.1°C
  • PSA: 83.06000
  • LogP: 2.76390
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