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Substance Name: epsilon-Dodecalactone
RN: 16429-21-3
UNII: Y9M87BIY21
InChIKey: FRTMRFCNTDDSOB-UHFFFAOYSA-N

Molecular Formula

  • C12-H22-O2

Molecular Weight

  • 198.304
 
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Names and Synonyms

Name of Substance

  • epsilon-Dodecalactone

Synonyms

  • 2-Oxepanone, 7-hexyl-
  • 6-Hexylhexanolide
  • 6-Hydroxydodecanoic acid epsilon-lactone
  • 7-Hexyl-2-oxepanone
  • BRN 4389436
  • Dodecanoic acid, 6-hydroxy-, epsilon-lactone
  • EINECS 240-483-7
  • epsilon-Dodecalactone
  • epsilon-Hydroxydodecanoic acid lactone
  • FEMA No. 3610
  • UNII-Y9M87BIY21

Systematic Names

  • 2-Oxepanone, 7-hexyl-
  • 7-Hexyloxepan-2-one
  • Dodecanoic acid, 6-hydroxy-, epsilon-lactone (6CI,7CI)

Superlist Name

  • epsilon-Dodecalactone

Registry Numbers

CAS Registry Number

  • 16429-21-3

FDA UNII

  • Y9M87BIY21

System Generated Number

  • 0016429213

Structure Descriptors

InChI

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

InChIKey

FRTMRFCNTDDSOB-UHFFFAOYSA-N

Smiles

O1[C@@H](CCCCC1=O)CCCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 7898mg/kg (7898mg/kg)   Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980.