| Identification | More | [Name]
2-ACETYLCYCLOHEXANONE | [CAS]
874-23-7 | [Synonyms]
2-Acetyl-1-cyclohexanone
2-acetyl-cyclohexanon
Acetylcyclohexanone
alpha-Acetylcyclohexanone
2-Acetylcyclohexanone,98%
2-acetylcyclohexan-1-one | [EINECS(EC#)]
212-858-5 | [Molecular Formula]
C8H12O2 | [MDL Number]
MFCD00001633 | [Molecular Weight]
140.18 | [MOL File]
874-23-7.mol |
| Chemical Properties | Back Directory | [Appearance]
clear colorless to light yellow liquid | [Melting point ]
-11°C | [Boiling point ]
111-112 °C/18 mmHg (lit.) | [density ]
1.078 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.509(lit.)
| [Fp ]
175 °F
| [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
soluble in Chloroform, Ethyl Acetate | [form ]
Liquid | [pka]
10.91±0.20(Predicted) | [color ]
Clear colorless to light yellow | [Water Solubility ]
Not miscible in water. | [BRN ]
1858621 | [InChI]
1S/C8H12O2/c1-6(9)7-4-2-3-5-8(7)10/h7H,2-5H2,1H3 | [InChIKey]
OEKATORRSPXJHE-UHFFFAOYSA-N | [SMILES]
CC(=O)C1CCCCC1=O | [CAS DataBase Reference]
874-23-7(CAS DataBase Reference) | [EPA Substance Registry System]
Cyclohexanone, 2-acetyl- (874-23-7) |
| Safety Data | Back Directory | [Safety Statements ]
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes . | [WGK Germany ]
3
| [TSCA ]
Yes | [HS Code ]
29142990 | [Storage Class]
10 - Combustible liquids |
| Hazard Information | Back Directory | [Chemical Properties]
clear colorless to light yellow liquid | [Uses]
2-Acetylcyclohexanone is used in the synthesis of 1-(pyridyl)ethanol derivatives that can reduce keto-esters and ketones. Also used in the synthesis of phenothiazine derivatives that can inhibit prote
in farnesyltransferase molecules and some that show anti-proliferative activity. | [General Description]
The keto-enol tautomerism of 2-acetylcyclohexanone (ACHE) in water was studied. | [Purification Methods]
Dissolve it in ligroin (b 30-60o), wash it with saturated aqueous NaHCO3, dry over Drierite and fractionate in a vacuum. [Perfetti & Levine J Am Chem Soc 75 626 1953, Manyik et al. J Am Chem Soc 75 5030 1953, Eistert & Reiss Chem Ber 87 108 1954.] It forms a Cu salt which crystallises in green leaflets from EtOH, m 162-163o [UV: McEntee & Pinder J Chem Soc 4419 1957]. |
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