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Substance Name: 2,6,10-Trimethyl-9-undecenal
RN: 141-13-9
UNII: JNM5JFE28J
InChIKey: UEGBWDUVDAKUGA-UHFFFAOYSA-N

Molecular Formula

  • C14-H26-O

Molecular Weight

  • 210.358
 
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Names and Synonyms

Name of Substance

  • 2,6,10-Trimethyl-9-undecenal

Synonyms

  • 2,6,10-Trimethyl-9-undecen-1-al
  • 2,6,10-Trimethyl-9-undecenal
  • Adoxal
  • AI3-36109
  • Doxal
  • EINECS 205-460-8
  • Farenal
  • NSC 122698
  • Trimethyl undecylenic aldehyde
  • UNII-JNM5JFE28J

Systematic Names

  • 2,6,10-Trimethylundec-9-enal
  • 9-Undecenal, 2,6,10-trimethyl-

Registry Numbers

CAS Registry Number

  • 141-13-9

FDA UNII

  • JNM5JFE28J

System Generated Number

  • 0000141139

Structure Descriptors

InChI

1S/C14H26O/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15/h7,11,13-14H,5-6,8-10H2,1-4H3

InChIKey

UEGBWDUVDAKUGA-UHFFFAOYSA-N

Smiles

C(=C\CC[C@@H](CCC[C@@H](C=O)C)C)(\C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 30(Suppl), Pg. 133S, 1992.
rat LDLo oral 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 30(Suppl), Pg. 133S, 1992.