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Substance Name: 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-hydroxy-, O-2-propynyloxime, monohydrochloride, (E)-
RN: 145427-95-8
InChIKey: WBOUJGLQXVBYAT-HCUGZAAXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H12-N2-O2.Cl-H

Molecular Weight

  • 216.6667
 
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Names and Synonyms

Synonym

  • 1-Hydroxy-1,2,5,6-tetrahydropyridine-3-carboxaldehyde-O-2-propynyloxime hydrochloride

Systematic Name

  • 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-hydroxy-, O-2-propynyloxime, monohydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 145427-95-8

System Generated Number

  • 0145427958

Molecular Formulas

Molecular Formula

  • C9-H12-N2-O2.Cl-H

Molecular Formula Fragments

  • C9-H12-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C9H12N2O2.ClH/c1-2-6-13-10-7-9-4-3-5-11(12)8-9;/h1,4,7,12H,3,5-6,8H2;1H/b10-7+;

InChIKey

WBOUJGLQXVBYAT-HCUGZAAXSA-N

Smiles

C#CCO/N=C/C1=CCCN(C1)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 80mg/kg (80mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 27, Pg. 519, 1992.