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Substance Name: Butyric acid, 2-(3-acetamido-2,4,6-triiodophenyl)-
RN: 23279-53-0
InChIKey: DRNUVHPHNAYHHF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H12-I3-N-O3

Molecular Weight

  • 598.931
 
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Names and Synonyms

Synonyms

  • 2-(3-Acetamido-2,4,6-triiodophenyl)butyric acid
  • BRN 3037425

Systematic Name

  • Butyric acid, 2-(3-acetamido-2,4,6-triiodophenyl)-

Registry Numbers

CAS Registry Number

  • 23279-53-0

System Generated Number

  • 0023279530

Structure Descriptors

InChI

1S/C12H12I3NO3/c1-3-6(12(18)19)9-7(13)4-8(14)11(10(9)15)16-5(2)17/h4,6H,3H2,1-2H3,(H,16,17)(H,18,19)

InChIKey

DRNUVHPHNAYHHF-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)cc1I)NC(C)=O)I)[C@@H](C(O)=O)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 950mg/kg (950mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 559, 1970.
mouse LD50 oral 2800mg/kg (2800mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 559, 1970.