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Substance Name: 1-Octen-3-yl acetate
RN: 2442-10-6
UNII: 2PZ32LCA02
InChIKey: DOJDQRFOTHOBEK-UHFFFAOYSA-N

Note

  • RIFM fragrance ingredient.

Molecular Formula

  • C10-H18-O2

Molecular Weight

  • 170.25
 
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Names and Synonyms

Name of Substance

  • 1-Octen-3-yl acetate

Synonyms

  • 1-Octen-3-ol, acetate
  • 1-Octen-3-yl acetate
  • 1-Pentylallyl acetate
  • 2-Octenyl acetate
  • 3-Acetoxy-1-octene
  • 3-Acetoxyoctene
  • 4-02-00-00192 (Beilstein Handbook Reference)
  • AI3-34394
  • Amyl crotonyl acetate
  • Amyl vinyl carbinol acetate
  • Amyl vinyl carbinyl acetate
  • BRN 1722392
  • EINECS 219-474-7
  • FEMA No. 3582
  • Octenyl acetate
  • Pentyl crotonyl acetate
  • Pentyl vinyl carbinol acetate
  • UNII-2PZ32LCA02

Systematic Names

  • 1-Octen-3-ol, 3-acetate
  • 1-Octen-3-ol, acetate
  • Oct-1-en-3-yl acetate

Superlist Name

  • 1-Octen-3-yl acetate

Registry Numbers

CAS Registry Number

  • 2442-10-6

FDA UNII

  • 2PZ32LCA02

Other Registry Numbers

  • 1629672-62-3
  • 74072-82-5

System Generated Number

  • 0002442106

Structure Descriptors

InChI

InChI=1S/C10H18O2/c1-4-6-7-8-10(5-2)12-9(3)11/h5,10H,2,4,6-8H2,1,3H3

InChIKey

DOJDQRFOTHOBEK-UHFFFAOYSA-N

Smiles

CCCCCC(OC(=O)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. 20, Pg. 641, 1982.
rat LD50 oral 850mg/kg (850mg/kg)   Food and Chemical Toxicology. Vol. 20, Pg. 641, 1982.