CAS 7500-42-7

2-Hydroxy-2,6,6-trimethylcyclohexanone

Description:

2-Hydroxy-2,6,6-trimethylcyclohexanone, also known by its CAS number 7500-42-7, is an organic compound characterized by its ketone functional group and a hydroxyl group. This compound features a cyclohexane ring with three methyl groups and a hydroxyl group attached to the carbon backbone, contributing to its unique structural properties. It is typically a colorless to pale yellow liquid with a pleasant odor, making it useful in various applications, including as a solvent and in the formulation of fragrances and flavorings. The presence of the hydroxyl group enhances its solubility in polar solvents, while the bulky methyl groups provide steric hindrance, influencing its reactivity and stability. Additionally, 2-Hydroxy-2,6,6-trimethylcyclohexanone can participate in various chemical reactions, such as oxidation and esterification, making it a versatile intermediate in organic synthesis. Safety data indicates that, like many organic compounds, it should be handled with care to avoid potential health hazards.

Formula: C₉H₁₆O₂

InChI: InChI=1S/C9H16O2/c1-8(2)5-4-6-9(3,11)7(8)10/h11H,4-6H2,1-3H3

InChI key: InChIKey=FWCGLHYHGUHPRY-UHFFFAOYSA-N

SMILES: O=C1C(C)(C)CCCC1(C)O

Synonyms:

• 6-Hydroxy-2,2,6-trimethylcyclohexanone
• Cyclohexanone, 2-hydroxy-2,6,6-trimethyl-
• Cyclohexanone, 2-hydroxy-2,6,6-trimethyl-
• 2,2,6-Trimethyl-6-hydroxycyclohexanone
• 2,6,6-trimethyl-2-hydroxycyclohexanone
• 2,6,6-Trimethyl-2-hydroxycyclohexanone
• 2-Hydroxy-2,6,6-trimethylcyclohexanone