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Substance Name: Piperazinium, 1-(3-(2-methyl-3a,4,7,7a-tetrahydro-2-isoindolinio)propyl)-1,4,4-trimethyl-, triiodide
RN: 74051-71-1
InChIKey: USPDBZPIONVGOE-UHFFFAOYSA-K

Molecular Formula

  • C19-H38-N3.3I

Molecular Weight

  • 689.2302
 
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Names and Synonyms

Synonym

  • 8-(N,N',N'-Trimethylpiperaziniumpropyl)-8-methyl-8-azonium bicyclo(4.3.0)nonene-2 triiodide

Systematic Name

  • Piperazinium, 1-(3-(2-methyl-3a,4,7,7a-tetrahydro-2-isoindolinio)propyl)-1,4,4-trimethyl-, triiodide

Registry Numbers

CAS Registry Number

  • 74051-71-1

System Generated Number

  • 0074051711

Molecular Formulas

Molecular Formula

  • C19-H38-N3.3I

Molecular Formula Fragments

  • C19-H38-N3
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C19H38N3.3HI/c1-20(2)12-14-21(3,15-13-20)10-7-11-22(4)16-18-8-5-6-9-19(18)17-22;;;/h5-6,18-19H,7-17H2,1-4H3;3*1H/q+3;;;/p-3

InChIKey

USPDBZPIONVGOE-UHFFFAOYSA-K

Smiles

C[N+]1(CC[N+](CC1)(C)CCC[N+]2(CC3CC=CCC3C2)C)C.[I-].[I-].[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01491,