Dehydrolinalyl acetate

CAS Registry Number®

29171-21-9

CAS Name

Dehydrolinalyl acetate

Molecular Formula

C12H18O2

Molecular Mass

194.27

Cite this Page

Dehydrolinalyl acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=29171-21-9 (retrieved 2024-11-25) (CAS RN: 29171-21-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    59-60 °C @ Press: 1 Torr

  • Density (2)

    0.920 g/cm³ @ Temp: 23 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H18O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h1,8H,7,9H2,2-5H3

InChIKey

InChIKey=JNVHVDDAOGRVDT-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

  • 6-Octen-1-yn-3-ol, 3,7-dimethyl-, 3-acetate
  • 6-Octen-1-yn-3-ol, 3,7-dimethyl-, acetate
  • 3,7-Dimethyl-3-acetoxy-6-octen-1-yne
  • Dehydrolinalyl acetate
  • Dehydrolinalool acetate

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Deleted or Replaced CAS Registry Numbers

60113-45-3

CAS INSIGHTSTM
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