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Substance Name: Malonic acid, 2-(3,5-diiodo-4-(4-hydroxy-3-iodophenoxy)benzyl)-
RN: 73747-63-4
InChIKey: XFXREEZEFAWCRI-UHFFFAOYSA-N

Molecular Formula

  • C16-H11-I3-O6

Molecular Weight

  • 679.957
 
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Names and Synonyms

Synonyms

  • 2-(3,5-Diiodo-4-(4-hydroxy-3-iodophenoxy)benzyl)malonic acid
  • 3,5,3'-Triiodo-beta-carboxydesaminothyronine
  • BRN 2681398

Systematic Name

  • Malonic acid, 2-(3,5-diiodo-4-(4-hydroxy-3-iodophenoxy)benzyl)-

Registry Numbers

CAS Registry Number

  • 73747-63-4

System Generated Number

  • 0073747634

Structure Descriptors

InChI

1S/C16H11I3O6/c17-10-6-8(1-2-13(10)20)25-14-11(18)4-7(5-12(14)19)3-9(15(21)22)16(23)24/h1-2,4-6,9,20H,3H2,(H,21,22)(H,23,24)

InChIKey

XFXREEZEFAWCRI-UHFFFAOYSA-N

Smiles

c1(CC(C(O)=O)C(O)=O)cc(c(Oc2cc(c(O)cc2)I)c(c1)I)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00939,