2,2,6-TRIMETHYLCYCLOHEXANONE

2,2,6-TRIMETHYLCYCLOHEXANONE
  • CAS No.:2408-37-9
Other grades of this product :
2,2,6-TRIMETHYLCYCLOHEXANONE Basic information
Product Name:2,2,6-TRIMETHYLCYCLOHEXANONE
Synonyms:1,1,3-Trimethyl-2-cyclohexanone;2,2,6-Trimethylcyclohexan-1-one;2,2,6-trimethyl-cyclohexanon;2,6,6-Trimethylcyclohexanone;2,2,6-TRIMETHYLCYCLOHEXANONE;2 2 6-TRIMETHYLCYCLOHEXANONE 98+%;Cyclohexanone, 2,2,6-trimethyl-;2,2,6-TRIMETHYLCYCLOHEXANONE 98.5+% (GC)
CAS:2408-37-9
MF:C9H16O
MW:140.22
EINECS:219-309-9
Product Categories:Alphabetical Listings;Flavors and Fragrances;Q-Z;C9;Carbonyl Compounds;Ketones
Mol File:2408-37-9.mol
2,2,6-TRIMETHYLCYCLOHEXANONE Chemical Properties
Melting point -31.8°C
Boiling point 178-179 °C(lit.)
density 0.904 g/mL at 25 °C(lit.)
refractive index n20/D 1.447(lit.)
FEMA 3473 | 2,2,6-TRIMETHYLCYCLOHEXANONE
Fp 125 °F
storage temp. Flammables area
Specific Gravity0.904
Water Solubility Slightly miscible with water.
JECFA Number1108
BRN 1905593
CAS DataBase Reference2408-37-9(CAS DataBase Reference)
EPA Substance Registry System2,2,6-Trimethylcyclohexanone (2408-37-9)
Safety Information
Risk Statements 10
Safety Statements 23-24/25
RIDADR UN 1224 3/PG 3
WGK Germany 3
TSCA Yes
HazardClass 3
PackingGroup III
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
ALFA English
2,2,6-TRIMETHYLCYCLOHEXANONE Usage And Synthesis
Chemical PropertiesCLEAR COLOURLESS LIQUID
OccurrenceReported found in bilberries, passion fruit and tea. Also reported found in apricot, bilberry, white wine, black tea, green tea, microbial fermented tea, brewed tea, yellow passion fruit juice and dill herb.
Uses2,2,6-Trimethylcyclohexanone is used as a flavoring agent. It is also used to prepare terpene viz. beta-ionone.
Aroma threshold valuesDetection: 100 ppb; recognition: 310 ppb
Synthesis Reference(s)Journal of the American Chemical Society, 80, p. 4072, 1958 DOI: 10.1021/ja01548a061The Journal of Organic Chemistry, 27, p. 1615, 1962 DOI: 10.1021/jo01052a031
Purification MethodsPurify it via the semicarbazone (m 218o, from MeOH or EtOH), decompose this in the usual way (cf p 65 and 67, or MEK, p 106) and fractionally distil the liquid ketone through a vigreux column (p 11) at ~760mm. [Chakravarti J Chem Soc 1567 1947, Milas et al. J Am Chem Soc 70 1831 1948, Beilstein 7 I 24, 7 II 32, 7 III 7.]
2,2,6-TRIMETHYLCYCLOHEXANONE Preparation Products And Raw materials
Raw materialsβ-Lonone-->BETA-CYCLOCITRAL
Preparation Productsbeta-Damascenone-->Boronal

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