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Substance Name: Piperazinium, 1,1-dimethyl-4-(1-(2-methoxyphenyl)cyclohexyl)-, iodide
RN: 21602-40-4
InChIKey: XYDFTTNODHLJPP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H31-N2-O.I

Molecular Weight

  • 430.367
 
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Names and Synonyms

Synonyms

  • 1,1-Dimethyl-4-(1-(2-methoxyphenyl)cyclohexyl)piperazinium, iodide
  • Piperazine, 1-(1-(o-methoxyphenyl)cyclohexyl)-4-methyl-, monomethiodide

Systematic Name

  • Piperazinium, 1,1-dimethyl-4-(1-(2-methoxyphenyl)cyclohexyl)-, iodide

Registry Numbers

CAS Registry Number

  • 21602-40-4

System Generated Number

  • 0021602404

Molecular Formulas

Molecular Formula

  • C19-H31-N2-O.I

Molecular Formula Fragments

  • C19-H31-N2-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C18H28N2O.CH3I/c1-19-12-14-20(15-13-19)18(10-6-3-7-11-18)16-8-4-5-9-17(16)21-2;1-2/h4-5,8-9H,3,6-7,10-15H2,1-2H3;1H3

InChIKey

XYDFTTNODHLJPP-UHFFFAOYSA-N

Smiles

N1(CCN(CC1)C)C1(CCCCC1)c1c(cccc1)OC.CI

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 56mg/kg (56mg/kg)   Chimica Therapeutica. Vol. 3, Pg. 241, 1968.