2,3,6-Trimethylcyclohexanone

CAS Registry Number®

42185-47-7
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CAS Name

2,3,6-Trimethylcyclohexanone

Molecular Formula

C9H16O

Molecular Mass

140.22

Cite this Page

2,3,6-Trimethylcyclohexanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=42185-47-7 (retrieved 2024-07-23) (CAS RN: 42185-47-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    183-185 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H16O/c1-6-4-5-7(2)9(10)8(6)3/h6-8H,4-5H2,1-3H3

InChIKey

InChIKey=BUKYTXOAQJIBTL-UHFFFAOYSA-N

SMILES

CC1C(=O)C(C)CCC1C

Canonical SMILES

O=C1C(C)CCC(C)C1C

Other Names for this Substance

  • Cyclohexanone, 2,3,6-trimethyl-
  • 2,3,6-Trimethylcyclohexanone
  • 2,3,6-Trimethyl-1-cyclohexanone