2,4,4-Trimethyl-2-cyclohexen-1-one

CAS Registry Number®

13395-71-6
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CAS Name

2,4,4-Trimethyl-2-cyclohexen-1-one

Molecular Formula

C9H14O

Molecular Mass

138.21

Cite this Page

2,4,4-Trimethyl-2-cyclohexen-1-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13395-71-6 (retrieved 2024-08-15) (CAS RN: 13395-71-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    56.6-57.5 °C @ Press: 4.5 Torr

  • Melting Point (2)

    158 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H14O/c1-7-6-9(2,3)5-4-8(7)10/h6H,4-5H2,1-3H3

InChIKey

InChIKey=VIBRIVSJBYFUNF-UHFFFAOYSA-N

SMILES

CC1(C)C=C(C)C(=O)CC1

Canonical SMILES

O=C1C(=CC(C)(C)CC1)C

Other Names for this Substance

  • 2-Cyclohexen-1-one, 2,4,4-trimethyl-
  • 2,4,4-Trimethyl-2-cyclohexen-1-one
  • 2,4,4-Trimethyl-2-cyclohexenone