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Substance Name: 1,2,4-Ethanylylidene-1H-cyclobuta(cd)pentalen-3-amine, octahydro-N-(phenylmethyl)-
RN: 136375-93-4
InChIKey: ZWCQZHOWEDKJBN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H21-N

Molecular Weight

  • 251.3709
 
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Names and Synonyms

Synonyms

  • 8-(Benzylamino)pentacyclo(5.4.0.0(sup 2,6).0(sup 3,10).0(sup 5,9))undecane
  • BRN 4748737

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 136375-93-4

System Generated Number

  • 0136375934

Structure Descriptors

InChI

1S/C18H21N/c1-2-4-9(5-3-1)8-19-18-15-11-7-12-14-10(11)6-13(15)16(14)17(12)18/h1-5,10-19H,6-8H2

InChIKey

ZWCQZHOWEDKJBN-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CNC2C3C4CC5C2C6C3CC4C56

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.