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Substance Name: Cyclopentanone, 2-(2-hexen-1-yl)-
RN: 34687-46-2
InChIKey: XXQYRQXKTWEIFQ-SNAWJCMRSA-N

Classification Codes

  • Skin / Eye Irritant
  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C11-H18-O

Molecular Weight

  • 166.262
 
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Names and Synonyms

Synonyms

  • 2-(2-Hexenyl cyclopentanone)
  • AI3-36077
  • BRN 2356700
  • Hexenyl cyclopentanone
  • Hexenylcyclopentanone

Systematic Names

  • Cyclopentanone, 2-(2-hexen-1-yl)-
  • Cyclopentanone, 2-(2-hexenyl)-

Registry Numbers

CAS Registry Number

  • 34687-46-2

System Generated Number

  • 0034687462

Structure Descriptors

InChI

1S/C11H18O/c1-2-3-4-5-7-10-8-6-9-11(10)12/h4-5,10H,2-3,6-9H2,1H3/b5-4+

InChIKey

XXQYRQXKTWEIFQ-SNAWJCMRSA-N

Smiles

O=C1[C@@H](C\C=C\CCC)CCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 795, 1979.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 795, 1979.