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Substance Name: Iophenoxic acid [USP]
RN: 96-84-4
UNII: 73TJC7JGUY
InChIKey: GOIQOQCNFWYSTQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H11-I3-O3

Molecular Weight

  • 571.9049
 
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Names and Synonyms

Name of Substance

  • Iophenoic acid [INN]
  • Iophenoxic acid
  • Iophenoxic acid [USP]

Synonyms

  • 4-10-00-00719 (Beilstein Handbook Reference)
  • Acide iophenoique
  • Acide iophenoique [INN-French]
  • Acido iofenoico
  • Acido iofenoico [INN-Spanish]
  • Acidum iophenoicum
  • Acidum iophenoicum [INN-Latin]
  • alpha-(2,4,6-Triiodo-3-hydroxybenzyl)butyric acid
  • alpha-Ethyl-3-hydroxy-2,4,6-triiodohydrocinnamic acid
  • alpha-Ethyl-beta-(3-hydroxy-2,4,6-triiodophenyl)propionic acid
  • BRN 2868146
  • Iophenoic acid
  • Iophenoxic acid
  • Teridax
  • Triiodoethionic acid
  • UNII-73TJC7JGUY

Systematic Names

  • alpha-Ethyl-3-hydroxy-2,4,6-triiodobenzenepropanoic acid
  • alpha-Ethyl-3-hydroxy-2,4,6-triiodohydrocinnamic acid
  • Hydrocinnamic acid, alpha-ethyl-3-hydroxy-2,4,6-triiodo-

Registry Numbers

CAS Registry Number

  • 96-84-4

FDA UNII

  • 73TJC7JGUY

System Generated Number

  • 0000096844

Structure Descriptors

InChI

1S/C11H11I3O3/c1-2-5(11(16)17)3-6-7(12)4-8(13)10(15)9(6)14/h4-5,15H,2-3H2,1H3,(H,16,17)

InChIKey

GOIQOQCNFWYSTQ-UHFFFAOYSA-N

Smiles

CCC(Cc1c(cc(c(c1I)O)I)I)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous 203mg/kg (203mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

CARDIAC: PULSE RATE
Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 42, Pg. 476, 1953.
guinea pig LD50 intraperitoneal 570mg/kg (570mg/kg) BEHAVIORAL: ANTIPSYCHOTIC

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 42, Pg. 476, 1953.
mouse LD50 intraperitoneal 440mg/kg (440mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: ANTIPSYCHOTIC
Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 42, Pg. 476, 1953.
mouse LD50 intravenous 374mg/kg (374mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 997, 1970.
mouse LD50 oral 1850mg/kg (1850mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: ANTIPSYCHOTIC
Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 42, Pg. 476, 1953.
rat LD50 intraperitoneal 648mg/kg (648mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: ANTIPSYCHOTIC
Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 42, Pg. 476, 1953.
rat LD50 oral 2gm/kg (2000mg/kg)   Pharmazie. Vol. 12, Pg. 315, 1957.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 143.5 deg C   EXP

Physical property data is provided to ChemIDplus by SRC, Inc.