1-Octen-3-yl butyrate

CAS Registry Number®

16491-54-6

CAS Name

1-Octen-3-yl butyrate

Molecular Formula

C12H22O2

Molecular Mass

198.30

Cite this Page

1-Octen-3-yl butyrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=16491-54-6 (retrieved 2024-11-25) (CAS RN: 16491-54-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    111 °C @ Press: 20 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H22O2/c1-4-7-8-10-11(6-3)14-12(13)9-5-2/h6,11H,3-5,7-10H2,1-2H3

InChIKey

InChIKey=LZWFXVJBIZIHCH-UHFFFAOYSA-N

SMILES

C(OC(CCC)=O)(CCCCC)C=C

Canonical SMILES

O=C(OC(C=C)CCCCC)CCC

Other Names for this Substance

  • Butanoic acid, 1-ethenylhexyl ester
  • Butyric acid, 1-pentylallyl ester
  • 1-Octen-3-ol, butyrate
  • 1-Pentylallyl butyrate
  • 1-Octen-3-yl butyrate

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