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Substance Name: Citracetal
RN: 66408-78-4
InChIKey: KSDZVTNRVWBTFN-PKNBQFBNSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C12-H20-O2

Molecular Weight

  • 196.288
 
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Names and Synonyms

Results Name

  • Citracetal

Synonyms

  • Citracetal
  • Citral ethylene glycol acetal
  • Citral ethyleneglycol acetal
  • EINECS 266-344-0

Systematic Names

  • 1,3-Dioxolane, 2-(2,6-dimethyl-1,5-heptadien-1-yl)-
  • 1,3-Dioxolane, 2-(2,6-dimethyl-1,5-heptadienyl)-
  • 2-(2,6-Dimethyl-1,5-heptadienyl)-1,3-dioxolane

Registry Numbers

CAS Registry Number

  • 66408-78-4

System Generated Number

  • 0066408784

Structure Descriptors

InChI

1S/C12H20O2/c1-10(2)5-4-6-11(3)9-12-13-7-8-14-12/h5,9,12H,4,6-8H2,1-3H3/b11-9+

InChIKey

KSDZVTNRVWBTFN-PKNBQFBNSA-N

Smiles

C1(\C=C(\CC\C=C(\C)C)C)OCCO1

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. 749, 1979.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 749, 1979.