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Substance Name: 2-Octanol, 2-methyl-6-methylene-, acetate (ester)
RN: 88969-41-9
InChIKey: IRRIQZAIMANVTH-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C12-H22-O2

Molecular Weight

  • 198.304
 
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Names and Synonyms

Synonyms

  • 2-Methyl-6-methylene-2-octanol acetate (ester)
  • 3-Methylene-7-methyloctan-7-yl acetate
  • BRN 1864581
  • Dihydromyrcenyl acetate
  • EINECS 289-458-2

Systematic Names

  • 2-Methyl-6-methylene-2-octyl acetate
  • 2-Octanol, 2-methyl-6-methylene-, acetate (ester)

Registry Numbers

CAS Registry Number

  • 88969-41-9

System Generated Number

  • 0088969419

Structure Descriptors

InChI

1S/C12H22O2/c1-5-10(2)7-6-8-11(3)9-14-12(4)13/h11H,2,5-9H2,1,3-4H3

InChIKey

IRRIQZAIMANVTH-UHFFFAOYSA-N

Smiles

C([C@@H](CCCC(CC)=C)C)OC(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 2800mg/kg (2800mg/kg)   Food and Chemical Toxicology. Vol. 21, Pg. 847, 1983.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 21, Pg. 847, 1983.