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Substance Name: Benzenesulfonic acid, 2,4-diamino-, calcium salt (2:1)
RN: 51247-58-6
InChIKey: MOULIFDXMDLHBH-UHFFFAOYSA-L

Molecular Formula

  • C6-H8-N2-O3-S.1/2Ca

Molecular Weight

  • 414.475
 
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Names and Synonyms

Synonyms

  • 2,4-Diaminobenzenesulfonic acid, calcium salt
  • EINECS 257-082-8

Systematic Names

  • Benzenesulfonic acid, 2,4-diamino-, calcium salt (2:1)
  • Calcium bis(2,4-diaminobenzenesulphonate)

Registry Numbers

CAS Registry Number

  • 51247-58-6

Related Registry Number

  • 88-63-1 (Parent)

System Generated Number

  • 0051247586

Molecular Formulas

Molecular Formula

  • C6-H8-N2-O3-S.1/2Ca

Molecular Formula Fragments

  • C6-H8-N2-O3-S
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C6H8N2O3S.Ca/c2*7-4-1-2-6(5(8)3-4)12(9,10)11;/h2*1-3H,7-8H2,(H,9,10,11);/q;;+2/p-2

InChIKey

MOULIFDXMDLHBH-UHFFFAOYSA-L

Smiles

[Ca+2].c1(S(=O)(=O)[O-])c(N)cc(N)cc1.c1(c(cc(cc1)N)N)S(=O)(=O)[O-]