Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Neryl isobutyrate
RN: 2345-24-6
UNII: M9941BHL2O
InChIKey: OGJYXQFXLSCKTP-LCYFTJDESA-N

Molecular Formula

  • C14-H24-O2

Molecular Weight

  • 224.342
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Neryl isobutyrate

Synonyms

  • (Z)-2-Methylpropanoic acid 3,7-dimethyl-2,6-octadienyl ester
  • 3,7-Dimethyl-2,6-octadienyl 2-methylpropanoate, (Z)-
  • 3,7-Dimethyl-2,6-octadienyl 2-methylpropanoate, cis-
  • 3,7-Dimethyl-2,6-octadienyl isobutyrate, (Z)-
  • cis-3,7-Dimethyl-2,6-octadien-1-yl isobutyrate
  • EINECS 219-061-1
  • FEMA No. 2775
  • Isobutyric acid, 3,7-dimethyl-2,6-octadienyl ester, (Z)-
  • Neryl 2-methylpropanoate, cis-
  • Neryl isobutyrate
  • Neryl isobutyrate (natural)
  • Propanoic acid, 2-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (Z)-
  • UNII-M9941BHL2O

Systematic Names

  • Isobutyric acid, 3,7-dimethyl-2,6-octadienyl ester, (Z)- (8CI)
  • Neryl isobutyrate
  • Propanoic acid, 2-methyl-, (2Z)-3,7-dimethyl-2,6-octadien-1-yl ester
  • Propanoic acid, 2-methyl-, (2Z)-3,7-dimethyl-2,6-octadienyl ester
  • Propanoic acid, 2-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (Z)-

Superlist Name

  • Neryl isobutyrate

Registry Numbers

CAS Registry Number

  • 2345-24-6

FDA UNII

  • M9941BHL2O

System Generated Number

  • 0002345246

Structure Descriptors

InChI

1S/C14H24O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,9,12H,6,8,10H2,1-5H3/b13-9-

InChIKey

OGJYXQFXLSCKTP-LCYFTJDESA-N

Smiles

C(OC\C=C(/CC\C=C(\C)C)C)(C(C)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 26, Pg. 391, 1988.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Chemical Toxicology. Vol. 26, Pg. 391, 1988.