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Substance Name: Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride
RN: 27922-25-4
InChIKey: XKSBYDYETRIQTH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H21-N-O-S.Cl-H

Molecular Weight

  • 287.853
 
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Names and Synonyms

Synonym

  • 2-Piperidinoethyl p-tolyl sulfoxide hydrochloride

Systematic Name

  • Sulfoxide, 2-piperidinoethyl p-tolyl, hydrochloride

Registry Numbers

CAS Registry Number

  • 27922-25-4

System Generated Number

  • 0027922254

Molecular Formulas

Molecular Formula

  • C14-H21-N-O-S.Cl-H

Molecular Formula Fragments

  • C14-H21-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H21NOS.ClH/c1-13-5-7-14(8-6-13)17(16)12-11-15-9-3-2-4-10-15;/h5-8H,2-4,9-12H2,1H3;1H

InChIKey

XKSBYDYETRIQTH-UHFFFAOYSA-N

Smiles

N1(CCCCC1)CC[S@@](=O)c1ccc(cc1)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 62mg/kg (62mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 480, 1970.