Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzoic acid, 2,3,5-triiodo-, sodium salt
RN: 17274-12-3
InChIKey: LJJUZMKVODOVJY-UHFFFAOYSA-M

Classification Codes

  • Agricultural Chemical
  • Unspecified / Unclassified Pesticide

Molecular Formula

  • C7-H2-I3-O2.Na

Molecular Weight

  • 521.781
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 2,3,5-Triiodobenzoic acid sodium salt
  • Sodium 2,3,5-triiodobenzoate
  • TIBA sodium salt

Systematic Name

  • Benzoic acid, 2,3,5-triiodo-, sodium salt

Registry Numbers

CAS Registry Number

  • 17274-12-3

Related Registry Number

  • 88-82-4 (Parent)

System Generated Number

  • 0017274123

Molecular Formulas

Molecular Formula

  • C7-H2-I3-O2.Na

Molecular Formula Fragments

  • C7-H2-I3-O2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C7H3I3O2.Na/c8-3-1-4(7(11)12)6(10)5(9)2-3;/h1-2H,(H,11,12);/q;+1/p-1

InChIKey

LJJUZMKVODOVJY-UHFFFAOYSA-M

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 157mg/kg (157mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 117, Pg. 307, 1956.
rat LD50 oral 2200mg/kg (2200mg/kg)   Guide to the Chemicals Used in Crop Protection. Vol. 6, Pg. 504, 1973.