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Substance Name: Ammonium, (o-phenylenebis(oxy-2-butynylene))bis(triethyl-, diiodide
RN: 17124-31-1
InChIKey: DMLKPDTYGPJFKZ-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H42-N2-O2.2I

Molecular Weight

  • 668.43
 
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Names and Synonyms

Synonyms

  • (o-Phenylenebis(oxy-2-butynylene))bis(triethylammonium diiodide)
  • 1,2-Bis(4-diethylamino-2-butynyloxy)benzene diiodoethylate
  • 2-Butyn-1-aminium, 4,4'-(1,2-phenylenebis(oxy))bis(N,N,N-triethyl-, diiodide

Systematic Name

  • Ammonium, (o-phenylenebis(oxy-2-butynylene))bis(triethyl-, diiodide

Registry Numbers

CAS Registry Number

  • 17124-31-1

System Generated Number

  • 0017124311

Molecular Formulas

Molecular Formula

  • C26-H42-N2-O2.2I

Molecular Formula Fragments

  • C26-H42-N2-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C26H42N2O2.2HI/c1-7-27(8-2,9-3)21-15-17-23-29-25-19-13-14-20-26(25)30-24-18-16-22-28(10-4,11-5)12-6;;/h13-14,19-20H,7-12,21-24H2,1-6H3;2*1H/q+2;;/p-2

InChIKey

DMLKPDTYGPJFKZ-UHFFFAOYSA-L

Smiles

c1(OCC#CC[N+](CC)(CC)CC)c(OCC#CC[N+](CC)(CC)CC)cccc1.[IH-].[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 2620ug/kg (2.62mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 172, Pg. 78, 1968.