CAS 4775-69-3

1-Bromo-4,4-dimethyl-2-pentanone

Description:

1-Bromo-4,4-dimethyl-2-pentanone, with the CAS number 4775-69-3, is an organic compound characterized by the presence of a bromine atom and a ketone functional group. It features a five-carbon chain with two methyl groups attached to the fourth carbon and a bromine substituent at the first carbon. This compound is typically a colorless to pale yellow liquid with a distinctive odor. It is soluble in organic solvents but has limited solubility in water due to its hydrophobic alkyl chains. The presence of the bromine atom makes it a potential electrophile in various chemical reactions, including nucleophilic substitutions. Additionally, the ketone group contributes to its reactivity, allowing it to participate in condensation reactions and other transformations. Safety precautions should be taken when handling this compound, as it may pose health risks, including irritation to the skin and respiratory system. Overall, 1-Bromo-4,4-dimethyl-2-pentanone is utilized in organic synthesis and as an intermediate in the production of other chemical compounds.

Formula: C₇H₁₃BrO

InChI: InChI=1S/C7H13BrO/c1-7(2,3)4-6(9)5-8/h4-5H2,1-3H3

InChI key: InChIKey=BHNFDOWGCDXOOK-UHFFFAOYSA-N

SMILES: C(C(C)(C)C)C(CBr)=O

Synonyms:

• Bromomethyl neopentyl ketone
• 1-Bromo-4,4-dimethyl-2-pentanone
• NSC 9058
• 2-Pentanone, 1-bromo-4,4-dimethyl-