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Substance Name: Acetic acid, N-(5-(3,5-dibromo-4-oxo-2,5-cyclohexadienylideneamino)-2-hydroxy-3-methylbenzyl)iminodi-
RN: 27728-33-2
InChIKey: DHAYDAWXUHTHPV-UHFFFAOYSA-N

Molecular Formula

  • C18-H16-Br2-N2-O6

Molecular Weight

  • 516.14
 
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Names and Synonyms

Synonyms

  • BRN 2793126
  • Indoferron
  • NSC 117905

Systematic Names

  • Acetic acid, N-(5-(3,5-dibromo-4-oxo-2,5-cyclohexadienylideneamino)-2-hydroxy-3-methylbenzyl)iminodi-
  • Glycine, N-(carboxymethyl)-N-((5-((3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene)amino)-2-hydroxy-3-methylphenyl)methyl)- (9CI)

Registry Numbers

CAS Registry Number

  • 27728-33-2

System Generated Number

  • 0027728332

Structure Descriptors

InChI

1S/C18H16Br2N2O6/c1-9-2-11(21-12-4-13(19)18(28)14(20)5-12)3-10(17(9)27)6-22(7-15(23)24)8-16(25)26/h2-5,27H,6-8H2,1H3,(H,23,24)(H,25,26)

InChIKey

DHAYDAWXUHTHPV-UHFFFAOYSA-N

Smiles

c1(cc(CN(CC(O)=O)CC(O)=O)c(O)c(c1)C)\N=C1/C=C(C(=O)C(=C1)Br)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04789,