2-Allylcyclohexanone
- CAS NO.：94-66-6
- Empirical Formula: C9H14O
- Molecular Weight: 138.21
- MDL number: MFCD00043548
- EINECS: 202-352-2
- SAFETY DATA SHEET (SDS)
- Update Date: 2025-07-16 09:55:37
What is 2-Allylcyclohexanone?
Chemical properties
clear light yellow liquid
The Uses of 2-Allylcyclohexanone
2-Allylcyclohexanone may be used in the synthesis of the following:
- bicyclo[3.3.1]non-2-en-9-one
- R-(-)-epilachnene, an antipode of the defensive droplets from the Mexican bean beetle, Epilachna varivestis
Synthesis Reference(s)
Chemistry Letters, 13, p. 1721, 1984
Journal of the American Chemical Society, 85, p. 207, 1963 DOI: 10.1021/ja00885a021
The Journal of Organic Chemistry, 51, p. 421, 1986 DOI: 10.1021/jo00354a001
General Description
2-Allylcyclohexanone is a β,γ-unsaturated ketone. Selective oxidation of 2-allylcyclohexanone by benzonitrile-hydrogen peroxide has been reported. Asymmetric synthesis of 2-alkylcyclohexanones by alkylation of cyclohexanone enamines (III) of L-proline ester derivatives has been described. Oxidation of 2-allylcyclohexanone by 90% hydrogen peroxide catalyzed by arsonated polystyrene has been studied.
Properties of 2-Allylcyclohexanone
| Boiling point: | 94 °C/23 mmHg (lit.) |
| Density | 0.927 g/mL at 25 °C (lit.) |
| refractive index | n |
| Flash point: | >230 °F |
| form | clear liquid |
| color | Colorless to Light yellow to Light orange |
| Specific Gravity | 0.927 |
| Water Solubility | Insoluble |
| CAS DataBase Reference | 94-66-6(CAS DataBase Reference) |
| NIST Chemistry Reference | Cyclohexanone, 2-(2-propenyl)-(94-66-6) |
| EPA Substance Registry System | Cyclohexanone, 2-(2-propenyl)- (94-66-6) |
Safety information for 2-Allylcyclohexanone
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 2-Allylcyclohexanone
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