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Substance Name: Allyl cyclohexaneacetate
RN: 4728-82-9
UNII: M6J8835739
InChIKey: UECFOOSFSUDPOR-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C11-H18-O2

Molecular Weight

  • 182.2612
 
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Names and Synonyms

Name of Substance

  • Allyl cyclohexaneacetate

Synonyms

  • 2-Propen-1-yl cyclohexaneacetate
  • 2-Propenyl cyclohexaneacetate
  • 4-09-00-00039 (Beilstein Handbook Reference)
  • Acetic acid, cyclohexyl-, allyl ester
  • Allyl cyclohexaneacetate
  • Allyl cyclohexylacetate
  • Allyl hexahydrophenylacetate
  • BRN 2575626
  • Cyclohexaneacetic acid, 2-propenyl ester
  • Cyclohexaneacetic acid, allyl ester
  • Cyclohexylacetic acid allyl ester
  • EINECS 225-230-0
  • FEMA No. 2023
  • UNII-M6J8835739

Systematic Names

  • Allyl cyclohexaneacetate
  • Cyclohexaneacetic acid, 2-propen-1-yl ester
  • Cyclohexaneacetic acid, 2-propenyl ester
  • Cyclohexaneacetic acid, allyl ester

Superlist Name

  • Allyl cyclohexaneacetate

Registry Numbers

CAS Registry Number

  • 4728-82-9

FDA UNII

  • M6J8835739

System Generated Number

  • 0004728829

Structure Descriptors

InChI

1S/C11H18O2/c1-2-8-13-11(12)9-10-6-4-3-5-7-10/h2,10H,1,3-9H2

InChIKey

UECFOOSFSUDPOR-UHFFFAOYSA-N

Smiles

C1(CCCCC1)CC(=O)OCC=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 1250mg/kg (1250mg/kg)   Food and Cosmetics Toxicology. Vol. 15, Pg. 617, 1977.
rat LD50 oral 900mg/kg (900mg/kg)   Food and Cosmetics Toxicology. Vol. 15, Pg. 617, 1977.