3,5,5-Trimethyl-4-(1-methylethylidene)-2-cyclohexen-1-one

CAS Registry Number®

4705-09-3

CAS Name

3,5,5-Trimethyl-4-(1-methylethylidene)-2-cyclohexen-1-one

Molecular Formula

C12H18O

Molecular Mass

178.27

Cite this Page

3,5,5-Trimethyl-4-(1-methylethylidene)-2-cyclohexen-1-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4705-09-3 (retrieved 2024-12-23) (CAS RN: 4705-09-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    117-119 °C @ Press: 11 Torr

  • Density (1)

    0.9396 g/cm³ @ Temp: 16 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H18O/c1-8(2)11-9(3)6-10(13)7-12(11,4)5/h6H,7H2,1-5H3

InChIKey

InChIKey=MTLGZOPMHYWXRN-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C1C=C(C(=C(C)C)C(C)(C)C1)C

Other Names for this Substance

  • 2-Cyclohexen-1-one, 3,5,5-trimethyl-4-(1-methylethylidene)-
  • 2-Cyclohexen-1-one, 4-isopropylidene-3,5,5-trimethyl-
  • 3,5,5-Trimethyl-4-(1-methylethylidene)-2-cyclohexen-1-one
  • Isoxylitone
  • α-Isoxylitone

View All