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Substance Name: 1,2,4-Ethanylylidene-1H-cyclobuta(cd)pentalen-3-amine, octahydro-N-octyl-
RN: 136375-94-5
InChIKey: YJCSNXASFMCCDI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H31-N

Molecular Weight

  • 273.4609
 
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Names and Synonyms

Synonyms

  • 8-(Octylamino)pentacyclo(5.4.0.0(sup 2,6).0(sup 3,10).0(sup 5,9))undecane
  • BRN 4743888

Systematic Name

  • 1,2,4-Ethanylylidene-1H-cyclobuta(cd)pentalen-3-amine, octahydro-N-octyl-

Registry Numbers

CAS Registry Number

  • 136375-94-5

System Generated Number

  • 0136375945

Structure Descriptors

InChI

1S/C19H31N/c1-2-3-4-5-6-7-8-20-19-16-12-10-13-15-11(12)9-14(16)17(15)18(13)19/h11-20H,2-10H2,1H3

InChIKey

YJCSNXASFMCCDI-UHFFFAOYSA-N

Smiles

CCCCCCCCNC1C2C3CC4C1C5C2CC3C45

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 375, 1991.