CAS 850352-48-6

2-Bromo-1-(4-methylphenyl)-1-pentanone

Description:

2-Bromo-1-(4-methylphenyl)-1-pentanone, with the CAS number 850352-48-6, is an organic compound characterized by its bromine substituent and ketone functional group. It features a pentanone backbone, indicating a five-carbon chain with a ketone functional group at one end. The presence of a 4-methylphenyl group, which is a phenyl ring substituted with a methyl group at the para position, contributes to its aromatic characteristics and influences its reactivity and solubility. This compound is typically a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is likely to be soluble in organic solvents due to its hydrophobic nature, while its bromine atom may impart some polar characteristics. The compound can be utilized in organic synthesis, particularly in the development of pharmaceuticals or agrochemicals, due to its functional groups that allow for further chemical modifications. Safety precautions should be taken when handling this compound, as it may pose health risks typical of halogenated organic compounds.

Formula: C₁₂H₁₅BrO

InChI: InChI=1S/C12H15BrO/c1-3-4-11(13)12(14)10-7-5-9(2)6-8-10/h5-8,11H,3-4H2,1-2H3

InChI key: InChIKey=SAOSCHJZYMDGOB-UHFFFAOYSA-N

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

Synonyms:

• 2-Bromo-1-(4-methylphenyl)-1-pentanone
• 2-Bromo-1-(p-tolyl)pentan-1-one
• 1-Pentanone, 2-bromo-1-(4-methylphenyl)-