4-Phenylcyclohexanone
- CAS NO.：4894-75-1
- Empirical Formula: C12H14O
- Molecular Weight: 174.24
- MDL number: MFCD00001641
- EINECS: 225-517-0
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-08-21 22:41:43
What is 4-Phenylcyclohexanone?
Chemical properties
white to off-white crystalline powder
The Uses of 4-Phenylcyclohexanone
4-Phenylcyclohexanone is used in the synthesis of CCR2 antagonists for the treatment of rheumatoid arthritis, atherosclerosis and other disease states. Also used in the preparation of coumarins via dehydrogenation and Heck coupling reactions.
The Uses of 4-Phenylcyclohexanone
4-Phenylcyclohexanone was used in the preparation of new cardo diamine monomer, 1,1-bis[4-(4-aminophenoxy)phenyl]-4-phenylcyclohexane bearing a 4-phenylcyclohexylidene unit.
General Description
4-Phenylcyclohexanone undergoes Ruthenium-catalyzed reaction with tributylamine to yield 2-butyl-4-phenylcyclohexanone and 2,6-dibutyl-4-phenylcyclohexanone. Wittig reaction of 4-phenylcyclohexanone with (carbethoxymethylene)triphenylphosphorane under microwave irradiation has been investigated.
Properties of 4-Phenylcyclohexanone
| Melting point: | 73-77 °C (lit.) |
| Boiling point: | 158-160°C 16mm |
| Density | 0.97 g/cm3 (25℃) |
| refractive index | 1.5363 (estimate) |
| Flash point: | 100°C |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform, Methanol |
| form | Crystalline Powder |
| color | White to off-white |
| Water Solubility | slightly soluble |
| BRN | 2045904 |
| CAS DataBase Reference | 4894-75-1(CAS DataBase Reference) |
Safety information for 4-Phenylcyclohexanone
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral 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. 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 4-Phenylcyclohexanone
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