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Substance Name: Benzoic acid, 3,5-diamino-2,4,6-triiodo-, sodium salt
RN: 67032-28-4
InChIKey: YQFXVTZPIGAJRU-UHFFFAOYSA-M

Molecular Formula

  • C7-H4-I3-N2-O2.Na

Molecular Weight

  • 551.811
 
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Names and Synonyms

Synonyms

  • 3,5-Diamino-2,4,6-triiodobenzoic acid sodium salt
  • Sodium 3,5-diamino-2,4,6-triiodobenzoate

Systematic Name

  • Benzoic acid, 3,5-diamino-2,4,6-triiodo-, sodium salt

Registry Numbers

CAS Registry Number

  • 67032-28-4

Related Registry Number

  • 5505-16-8 (Parent)

System Generated Number

  • 0067032284

Molecular Formulas

Molecular Formula

  • C7-H4-I3-N2-O2.Na

Molecular Formula Fragments

  • C7-H4-I3-N2-O2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C7H5I3N2O2.Na/c8-2-1(7(13)14)3(9)6(12)4(10)5(2)11;/h11-12H2,(H,13,14);/q;+1/p-1

InChIKey

YQFXVTZPIGAJRU-UHFFFAOYSA-M

Smiles

c1(c(c(c(I)c(c1I)N)N)I)C(=O)[O-].[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 1370mg/kg (1370mg/kg)   Medicinal Chemistry, A Series of Reviews. Vol. 6, Pg. 343, 1963.