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Substance Name: 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide
RN: 109473-98-5
InChIKey: LRCNGFMMRCTFAE-JHGYPSGKSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H26-N-O.I

Molecular Weight

  • 351.2654
 
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Names and Synonyms

Synonym

  • 5-Butoxy-N,N-diethyl-N-methyl-4-penten-2-yn-1-aminium iodide

Systematic Name

  • 4-Penten-2-yn-1-aminium, 5-butoxy-N,N-diethyl-N-methyl-, iodide

Registry Numbers

CAS Registry Number

  • 109473-98-5

System Generated Number

  • 0109473985

Molecular Formulas

Molecular Formula

  • C14-H26-N-O.I

Molecular Formula Fragments

  • C14-H26-N-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C14H26NO.HI/c1-5-8-13-16-14-11-9-10-12-15(4,6-2)7-3;/h11,14H,5-8,12-13H2,1-4H3;1H/q+1;/p-1/b14-11+;

InChIKey

LRCNGFMMRCTFAE-JHGYPSGKSA-M

Smiles

CCCCO/C=C/C#CC[N+](C)(CC)CC.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 164mg/kg (164mg/kg)   Pharmaceutical Chemistry Journal Vol. 26, Pg. 162, 1992.