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Substance Name: Isooctadecanoic acid
RN: 2724-58-5
UNII: LZM5XA0ILL
InChIKey: XDOFQFKRPWOURC-UHFFFAOYSA-N

Molecular Formula

  • C18-H36-O2

Molecular Weight

  • 284.48
 
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Names and Synonyms

Name of Substance

  • 16-Methylheptadecanoic acid
  • Isooctadecanoic acid
  • Isostearic acid

Synonyms

  • EINECS 220-336-3
  • Prisorine 3509
  • UNII-LZM5XA0ILL

Systematic Names

  • 16-Methylheptadecanoic acid
  • Heptadecanoic acid, 16-methyl-

Registry Numbers

CAS Registry Number

  • 2724-58-5

FDA UNII

  • LZM5XA0ILL

System Generated Number

  • 0002724585

Structure Descriptors

InChI

1S/C18H36O2/c1-17(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(19)20/h17H,3-16H2,1-2H3,(H,19,20)

InChIKey

XDOFQFKRPWOURC-UHFFFAOYSA-N

Smiles

C(CCCCCCCCCCCCCCC(O)=O)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 32mL/kg (32mL/kg)   International Journal of Toxicology. Vol. 18(Suppl,