(+)-Whiskey lactone

CAS Registry Number®

80041-01-6

CAS Name

(+)-Whiskey lactone

Molecular Formula

C9H16O2

Molecular Mass

156.22

Cite this Page

(+)-Whiskey lactone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=80041-01-6 (retrieved 2024-11-22) (CAS RN: 80041-01-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    123-125 °C @ Press: 16 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H16O2/c1-3-4-5-8-7(2)6-9(10)11-8/h7-8H,3-6H2,1-2H3/t7-,8+/m0/s1

InChIKey

InChIKey=WNVCMFHPRIBNCW-JGVFFNPUSA-N

SMILES

C(CCC)[C@H]1OC(=O)C[C@@H]1C

Canonical SMILES

O=C1OC(CCCC)C(C)C1

Other Names for this Substance

  • 2(3H)-Furanone, 5-butyldihydro-4-methyl-, (4S,5R)-
  • 2(3H)-Furanone, 5-butyldihydro-4-methyl-, (4S-trans)-
  • (4S,5R)-5-Butyldihydro-4-methyl-2(3H)-furanone
  • (+)-trans-Whiskey lactone
  • (3S,4R)-3-Methyl-4-octanolide

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration