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Substance Name: 1-Penten-4-yn-3-one, 1,5-diphenyl-
RN: 16121-39-4
InChIKey: MDUZBUIGEQDGQH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H12-O

Molecular Weight

  • 232.281
 
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Names and Synonyms

Synonyms

  • 1,5-Diphenyl-1-penten-4-yn-3-one
  • Phenethynyl styryl ketone

Systematic Name

  • 1-Penten-4-yn-3-one, 1,5-diphenyl-

Registry Numbers

CAS Registry Number

  • 16121-39-4

System Generated Number

  • 0016121394

Structure Descriptors

InChI

1S/C17H12O/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-11,13H

InChIKey

MDUZBUIGEQDGQH-UHFFFAOYSA-N

Smiles

C(#Cc1ccccc1)C(\C=C\c1ccccc1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 15, Pg. 103, 1981.