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Substance Name: Propanenitrile, 3-(4-(1-cyclopenten-1-yl)phenoxy)-
RN: 105886-94-0
InChIKey: BBSBAIRUGDLYSN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H15-N-O

Molecular Weight

  • 213.2785
 
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Names and Synonyms

Synonyms

  • 3-(4-(1-Cyclopenten-1-yl)phenoxy)propanenitrile
  • BRN 5521085

Systematic Name

  • Propanenitrile, 3-(4-(1-cyclopenten-1-yl)phenoxy)-

Registry Numbers

CAS Registry Number

  • 105886-94-0

System Generated Number

  • 0105886940

Structure Descriptors

InChI

1S/C14H15NO/c15-10-3-11-16-14-8-6-13(7-9-14)12-4-1-2-5-12/h4,6-9H,1-3,5,11H2

InChIKey

BBSBAIRUGDLYSN-UHFFFAOYSA-N

Smiles

c1cc(ccc1C2=CCCC2)OCCC#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 25, Pg. 106, 1986.