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Substance Name: Piperidinium, 1-benzyl-4-cyano-1-methyl-4-phenyl-, iodide
RN: 73771-87-6
InChIKey: ZWLVVBPWCGVFJX-UHFFFAOYSA-M

Molecular Formula

  • C20-H23-N2.I

Molecular Weight

  • 418.3157
 
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Names and Synonyms

Synonym

  • 1-Benzyl-4-cyano-1-methyl-4-phenylpiperidinium iodide

Systematic Name

  • Piperidinium, 1-benzyl-4-cyano-1-methyl-4-phenyl-, iodide

Registry Numbers

CAS Registry Number

  • 73771-87-6

System Generated Number

  • 0073771876

Molecular Formulas

Molecular Formula

  • C20-H23-N2.I

Molecular Formula Fragments

  • C20-H23-N2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C20H23N2.HI/c1-22(16-18-8-4-2-5-9-18)14-12-20(17-21,13-15-22)19-10-6-3-7-11-19;/h2-11H,12-16H2,1H3;1H/q+1;/p-1

InChIKey

ZWLVVBPWCGVFJX-UHFFFAOYSA-M

Smiles

C[N+]1(CCC(CC1)(C#N)c2ccccc2)Cc3ccccc3.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 32mg/kg (32mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01050,