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Substance Name: I.S. 3122
RN: 13073-15-9
InChIKey: QDHUQMPIRLHXNS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H22-N2-O.2Cl-H

Molecular Weight

  • 319.274
 
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Names and Synonyms

Results Name

  • I.S. 3122

Synonyms

  • 1-(3-Aminopropyl)-4-phenyl-4-piperidinecarboxaldehyde dihydrochloride
  • 1-(3-Aminopropyl)-4-phenylisonipecotaldehyde dihydrochloride
  • 1-(gamma-Amminopropil)-4-fenil-4-formilpiperidina dicloridrato
  • 1-(gamma-Amminopropil)-4-fenil-4-formilpiperidina dicloridrato [Italian]
  • I.S. 3122

Systematic Name

  • Isonipecotaldehyde, 1-(3-aminopropyl)-4-phenyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 13073-15-9

System Generated Number

  • 0013073159

Molecular Formulas

Molecular Formula

  • C15-H22-N2-O.2Cl-H

Molecular Formula Fragments

  • C15-H22-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H22N2O.2ClH/c16-9-4-10-17-11-7-15(13-18,8-12-17)14-5-2-1-3-6-14;;/h1-3,5-6,13H,4,7-12,16H2;2*1H

InChIKey

QDHUQMPIRLHXNS-UHFFFAOYSA-N

Smiles

C1(c2ccccc2)(CC[NH+](CCC[NH3+])CC1)C=O.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   Farmaco, Edizione Scientifica. Vol. 22, Pg. 12, 1967.