Linalyl acetate

CAS Registry Number®

115-95-7
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CAS Name

Linalyl acetate

Molecular Formula

C12H20O2

Molecular Mass

196.29

Cite this Page

Linalyl acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=115-95-7 (retrieved 2024-04-16) (CAS RN: 115-95-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    220 °C

  • Melting Point (2)

    <25 °C

  • Density (3)

    0.8997 g/cm³ @ Temp: 15 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
  • (2) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
  • (3) Semi-ann. report, (1920), CAplus

Other Names and Identifiers

InChI

InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3

InChIKey

InChIKey=UWKAYLJWKGQEPM-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1,6-Octadien-3-ol, 3,7-dimethyl-, 3-acetate
  • 1,6-Octadien-3-ol, 3,7-dimethyl-, acetate
  • Linalool acetate
  • Acetic acid linalool ester
  • Bergamiol

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Deleted or Replaced CAS Registry Numbers

8022-85-3, 16509-66-3, 40135-38-4

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