CAS 898765-66-7

1-(3,5-Dimethylphenyl)-2,2-dimethyl-1-butanone

Description:

1-(3,5-Dimethylphenyl)-2,2-dimethyl-1-butanone, identified by its CAS number 898765-66-7, is an organic compound characterized by its ketone functional group. This substance features a bulky structure due to the presence of both a dimethylphenyl group and a dimethyl group on the butanone backbone, which contributes to its unique physical and chemical properties. Typically, compounds of this nature exhibit moderate volatility and may have a distinct aromatic odor, influenced by the phenyl ring. The presence of multiple methyl groups can enhance hydrophobic characteristics, making the compound less soluble in water but more soluble in organic solvents. Additionally, the steric hindrance introduced by the bulky groups can affect reactivity, potentially leading to selective reactions in synthetic applications. As with many organic compounds, safety data should be consulted to understand its handling, storage, and potential hazards. Overall, this compound may find applications in organic synthesis, fragrance formulation, or as an intermediate in chemical manufacturing processes.

Formula: C₁₄H₂₀O

InChI: InChI=1S/C14H20O/c1-6-14(4,5)13(15)12-8-10(2)7-11(3)9-12/h7-9H,6H2,1-5H3

InChI key: InChIKey=ZKGGJHPGFBVPQX-UHFFFAOYSA-N

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

Synonyms:

• 1-(3,5-Dimethylphenyl)-2,2-dimethyl-1-butanone
• 1-Butanone, 1-(3,5-dimethylphenyl)-2,2-dimethyl-