CAS 862088-21-9

2-Hydroxy-4-(1-methylethyl)benzonitrile

Description:

2-Hydroxy-4-(1-methylethyl)benzonitrile, also known by its CAS number 862088-21-9, is an organic compound characterized by a benzene ring substituted with a hydroxyl group and a benzonitrile group. The presence of the hydroxyl (-OH) group indicates that it is a phenolic compound, which can exhibit hydrogen bonding and contribute to its solubility in polar solvents. The isopropyl group (1-methylethyl) attached to the benzene ring enhances its hydrophobic character, influencing its overall solubility and reactivity. This compound may exhibit biological activity, making it of interest in pharmaceutical research. Its structural features suggest potential applications in various chemical syntheses or as an intermediate in the production of other chemical entities. Additionally, the nitrile group (-C≡N) can participate in nucleophilic reactions, further expanding its utility in organic synthesis. Overall, 2-Hydroxy-4-(1-methylethyl)benzonitrile is a versatile compound with properties that can be tailored for specific applications in chemistry and materials science.

Formula: C₁₀H₁₁NO

InChI: InChI=1S/C10H11NO/c1-7(2)8-3-4-9(6-11)10(12)5-8/h3-5,7,12H,1-2H3

InChI key: InChIKey=HYHHIEDVCXUQTM-UHFFFAOYSA-N

SMILES: C(C)(C)C1=CC(O)=C(C#N)C=C1

Synonyms:

• 2-Hydroxy-4-isopropylbenzonitrile
• Benzonitrile, 2-hydroxy-4-(1-methylethyl)-
• 2-Hydroxy-4-(propan-2-yl)benzonitrile
• 2-Hydroxy-4-(1-methylethyl)benzonitrile