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Substance Name: Acetic acid, 2-(2-(3-acetamido-2,4,6-triiodophenoxy)ethoxy)-2-(o-tolyl)-, sodium salt
RN: 101651-77-8
InChIKey: SKNQULYUAPLIER-UHFFFAOYSA-M

Molecular Formula

  • C19-H17-I3-N-O5.Na

Molecular Weight

  • 743.035
 
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Names and Synonyms

Synonym

  • 2-(2-(3-Acetamido-2,4,6-triiodophenoxy)ethoxy)-2-(o-tolyl)acetic acid sodium salt

Systematic Name

  • Acetic acid, 2-(2-(3-acetamido-2,4,6-triiodophenoxy)ethoxy)-2-(o-tolyl)-, sodium salt

Registry Numbers

CAS Registry Number

  • 101651-77-8

System Generated Number

  • 0101651778

Molecular Formulas

Molecular Formula

  • C19-H17-I3-N-O5.Na

Molecular Formula Fragments

  • C19-H17-I3-N-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C19H18I3NO5.Na/c1-10-5-3-4-6-12(10)17(19(25)26)27-7-8-28-18-14(21)9-13(20)16(15(18)22)23-11(2)24;/h3-6,9,17H,7-8H2,1-2H3,(H,23,24)(H,25,26);/q;+1/p-1

InChIKey

SKNQULYUAPLIER-UHFFFAOYSA-M

Smiles

c1(c(c(c(I)cc1I)NC(C)=O)I)OCCO[C@@H](c1c(cccc1)C)C(=O)[O-].[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 585mg/kg (585mg/kg)   Farmaco, Edizione Scientifica. Vol. 31, Pg. 349, 1976.
mouse LD50 oral 3550mg/kg (3550mg/kg)   Farmaco, Edizione Scientifica. Vol. 31, Pg. 349, 1976.