Linalyl isobutyrate

CAS Registry Number®

78-35-3
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CAS Name

Linalyl isobutyrate

Molecular Formula

C14H24O2

Molecular Mass

224.34

Cite this Page

Linalyl isobutyrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=78-35-3 (retrieved 2024-04-26) (CAS RN: 78-35-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    63-65 °C @ Press: 0.1 Torr

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=JZIARAQCPRDGAC-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Propanoic acid, 2-methyl-, 1-ethenyl-1,5-dimethyl-4-hexen-1-yl ester
  • Isobutyric acid, 1,5-dimethyl-1-vinyl-4-hexenyl ester
  • Propanoic acid, 2-methyl-, 1-ethenyl-1,5-dimethyl-4-hexenyl ester
  • Isobutyric acid, linalyl ester
  • 1,6-Octadien-3-ol, 3,7-dimethyl-, isobutyrate

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Deleted or Replaced CAS Registry Numbers

94346-07-3

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