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Substance Name: 5,5'-(Dodecanedioyldiimino)-bis(2,4,6-triiodo-N-methylisophthalamate
RN: 10397-78-1
UNII: I7GB1YG0GB
InChIKey: WPTAMNDITBLLSY-UHFFFAOYSA-N

Molecular Formula

  • C30-H32-I6-N4-O8

Molecular Weight

  • 1338.0
 
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Names and Synonyms

Name of Substance

  • 5,5'-(Dodecanedioyldiimino)-bis(2,4,6-triiodo-N-methylisophthalamate

Synonyms

  • 5,5'-(Decamethylenebis(carbonylimino))bis(N-methyl-2,4,6-triiodoisophthalamic acid)
  • BRN 2800653
  • UNII-I7GB1YG0GB

Systematic Name

  • Isophthalamic acid, 5,5'-(decamethylenebis(carbonylimino))bis(N-methyl-2,4,6-triiodo-

Registry Numbers

CAS Registry Number

  • 10397-78-1

FDA UNII

  • I7GB1YG0GB

System Generated Number

  • 0010397781

Structure Descriptors

InChI

1S/C30H32I6N4O8/c1-37-27(43)15-19(31)17(29(45)46)23(35)25(21(15)33)39-13(41)11-9-7-5-3-4-6-8-10-12-14(42)40-26-22(34)16(28(44)38-2)20(32)18(24(26)36)30(47)48/h3-12H2,1-2H3,(H,37,43)(H,38,44)(H,39,41)(H,40,42)(H,45,46)(H,47,48)

InChIKey

WPTAMNDITBLLSY-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)c(c1I)C(O)=O)C(NC)=O)I)NC(CCCCCCCCCCC(Nc1c(c(c(I)c(c1I)C(O)=O)C(NC)=O)I)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 4800mg/kg (4800mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 964, 1966.