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Substance Name: 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-(acetyloxy)-, 3-(O-methyloxime), (E)-
RN: 145071-52-9
InChIKey: KBJGSNOAFQOHHC-UXBLZVDNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H14-N2-O3

Molecular Weight

  • 182.2216
 
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Names and Synonyms

Synonyms

  • (E)-1,2,5,6-Tetrahydro-1-(acetyloxy)-3-pyridinecarboxaldehyde 3-(O-methyloxime)
  • 1-Acetoxy-1,2,5,6-tetrahydropyridine-3-carboxaldehyde-O-methyloxime
  • BRN 5811985

Systematic Name

  • 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-(acetyloxy)-, 3-(O-methyloxime), (E)-

Registry Numbers

CAS Registry Number

  • 145071-52-9

System Generated Number

  • 0145071529

Structure Descriptors

InChI

1S/C9H14N2O2/c1-8(12)11-5-3-4-9(7-11)6-10-13-2/h4,6H,3,5,7H2,1-2H3/b10-6+

InChIKey

KBJGSNOAFQOHHC-UXBLZVDNSA-N

Smiles

CC(=O)N1CCC=C(C1)/C=N/OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 100mg/kg (100mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 27, Pg. 519, 1992.