Product Name

  • Name

    1,3-BENZENEDISULFONIC ACID, 4-[[(1,1-DIMETHYLETHYL)OXIDOIMINO]METHYL]-,DISODIUM SALT

  • EINECS
  • CAS No. 168021-79-2
  • Density
  • Solubility
  • Melting Point >300 °C
  • Formula C11H15NO7S2.2Na
  • Boiling Point
  • Molecular Weight 381.333
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 168021-79-2 (1,3-BENZENEDISULFONIC ACID, 4-[[(1,1-DIMETHYLETHYL)OXIDOIMINO]METHYL]-,DISODIUM SALT)
  • Hazard Symbols
  • Synonyms 1,3-Benzenedisulfonicacid, 4-[[(1,1-dimethylethyl)imino]methyl]-, N-oxide, disodium salt;1,3-Benzenedisulfonic acid, 4-[[(1,1-dimethylethyl)oxidoimino]methyl]-,disodium salt (9CI);ARL 16556;CPI 22;CXY 059;Cerovive;NXY 059;
  • PSA 159.91000
  • LogP 2.90730

NXY-059 Chemical Properties

Product Name: Disufenton sodium (CAS NO.168021-79-2)

Molecular Formula: C11H13NNa2O7S2
Molecular Weight: 381.333g/mol
Mol File: 168021-79-2.mol
H-Bond Donor: 0
H-Bond Acceptor: 7
Structure Descriptors of Disufenton sodium (CAS NO.168021-79-2):
  IUPAC Name: disodium4-[(Z)-[tert-butyl(oxido)azaniumylidene]methyl]benzene-1,3-disulfonate
  Canonical SMILES: CC(C)(C)[N+](=CC1=C(C=C(C=C1)S(=O)(=O)[O-])S(=O)(=O)[O-])[O-].[Na+].[Na+]
  Isomeric SMILES: CC(C)(C)/[N+](=C/C1=C(C=C(C=C1)S(=O)(=O)[O-])S(=O)(=O)[O-])/[O-].[Na+].[Na+]
  InChI: InChI=1S/C11H15NO7S2.2Na/c1-11(2,3)12(13)7-8-4-5-9(20(14,15)16)6-10(8)21(17,18)19;;/h4-7H,1-3H3,(H,14,15,16)(H,17,18,19);;/q;2*+1/p-2/b12-7-;; 
  InChIKey: XLZOVRYBVCMCGL-BPNVQINPSA-L 

NXY-059 Specification

  Disufenton sodium , its CAS NO. is 168021-79-2, the synonyms are 1,3-Benzenedisulfonic acid, 4-(((1,1-dimethylethyl)oxidoimino)methyl)-, disodium salt ; ARL 16556 ; CPI 22 ; NXY-059 ; Disodium (tert-butylimino)methyl)benzene-1,3-disulfonate N-oxide ; Disodium 4-(((1,1-dimethylethyl)imino)methyl)benzene-1,3-disulfonate N-oxide ; Disodium 4-tert-butyliminomethyl)benzene-,3-disulfonate N-oxide ; NXY-059 ; UNII-7M1J3HN9VO .

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