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Substance Name: 3-Amino-5-acetamido-2,4,6-triiodobenzoate
RN: 1713-07-1
InChIKey: XCNHOBHCZBIGJP-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C9-H7-I3-N2-O3

Molecular Weight

  • 571.865
 
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Names and Synonyms

Name of Substance

  • 3-Amino-5-acetamido-2,4,6-triiodobenzoate

Synonyms

  • 3-Acetamido-5-amino-2,4,6-triiodobenzoic acid
  • 4-14-00-01307 (Beilstein Handbook Reference)
  • BRN 2753434
  • EINECS 216-987-8

Systematic Names

  • 3-(Acetylamino)-5-amino-2,4,6-triiodobenzoic acid
  • Benzoic acid, 3-acetamido-5-amino-2,4,6-triiodo-

Registry Numbers

CAS Registry Number

  • 1713-07-1

System Generated Number

  • 0001713071

Structure Descriptors

InChI

1S/C9H7I3N2O3/c1-2(15)14-8-5(11)3(9(16)17)4(10)7(13)6(8)12/h13H2,1H3,(H,14,15)(H,16,17)

InChIKey

XCNHOBHCZBIGJP-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)c(c1I)N)C(O)=O)I)NC(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 7200mg/kg (7200mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 116, Pg. 394, 1956.