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Substance Name: Piperidinium, 1,1-bis(3-chloro-4-(p-tolyl)-2-butenyl)-, chloride
RN: 34552-18-6
InChIKey: FMZSHMCZWKQPSR-GHSDEOKXSA-M

Molecular Formula

  • C27-H34-Cl2-N.Cl

Molecular Weight

  • 478.932
 
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Names and Synonyms

Synonym

  • 1,1-Bis(3-chloro-4-(p-tolyl)-2-butenyl)piperidinium chloride

Systematic Name

  • Piperidinium, 1,1-bis(3-chloro-4-(p-tolyl)-2-butenyl)-, chloride

Registry Numbers

CAS Registry Number

  • 34552-18-6

System Generated Number

  • 0034552186

Molecular Formulas

Molecular Formula

  • C27-H34-Cl2-N.Cl

Molecular Formula Fragments

  • C27-H34-Cl2-N
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C27H34Cl2N.ClH/c1-22-6-10-24(11-7-22)20-26(28)14-18-30(16-4-3-5-17-30)19-15-27(29)21-25-12-8-23(2)9-13-25;/h6-15H,3-5,16-21H2,1-2H3;1H/q+1;/p-1/b26-14-,27-15-;

InChIKey

FMZSHMCZWKQPSR-GHSDEOKXSA-M

Smiles

[N+]1(CCCCC1)(C\C=C(\Cc1ccc(cc1)C)Cl)C\C=C(\Cc1ccc(cc1)C)Cl.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 28mg/kg (28mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.
rat LD50 intraperitoneal 28mg/kg (28mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.