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Substance Name: Ammonium, (4-(2-oxocyclopentyl)-2-butynyl)trimethyl-, iodide
RN: 3921-89-9
InChIKey: XRAPMVJWJVMPHD-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H20-N-O.I

Molecular Weight

  • 321.196
 
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Names and Synonyms

Synonym

  • Trimethyl(4-(2-oxocyclopentyl)but-2-ynyl)ammonium iodide

Systematic Name

  • Ammonium, (4-(2-oxocyclopentyl)-2-butynyl)trimethyl-, iodide

Registry Numbers

CAS Registry Number

  • 3921-89-9

System Generated Number

  • 0003921899

Molecular Formulas

Molecular Formula

  • C12-H20-N-O.I

Molecular Formula Fragments

  • C12-H20-N-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C12H20NO.HI/c1-13(2,3)10-5-4-7-11-8-6-9-12(11)14;/h11H,6-10H2,1-3H3;1H/q+1;/p-1

InChIKey

XRAPMVJWJVMPHD-UHFFFAOYSA-M

Smiles

C1([C@@H](CCC1)CC#CC[N+](C)(C)C)=O.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 15mg/kg (15mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 26, Pg. 56, 1966.