α-Damascone

CAS Registry Number®

43052-87-5

CAS Name

α-Damascone

Molecular Formula

C13H20O

Molecular Mass

192.30

Cite this Page

α-Damascone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=43052-87-5 (retrieved 2024-12-29) (CAS RN: 43052-87-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    253-255 °C @ Press: 760 Torr

  • Density (1)

    0.9229 g/cm³ @ Temp: 27 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7-8,12H,6,9H2,1-4H3

InChIKey

InChIKey=CRIGTVCBMUKRSL-UHFFFAOYSA-N

SMILES

C(C=CC)(=O)C1C(C)(C)CCC=C1C

Canonical SMILES

O=C(C=CC)C1C(=CCCC1(C)C)C

Other Names for this Substance

  • 2-Buten-1-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-
  • 1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-2-buten-1-one
  • 2,6,6-Trimethyl-1-crotonyl-2-cyclohexene
  • α-Damascone
  • 1-(2,6,6-Trimethyl-2-cyclohexenyl)-2-buten-1-one

Deleted or Replaced CAS Registry Numbers

72748-70-0

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