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CAS 898764-38-0

:

1-(4-Bromophenyl)-3,3-dimethyl-1-butanone

Description:
1-(4-Bromophenyl)-3,3-dimethyl-1-butanone, identified by its CAS number 898764-38-0, is an organic compound characterized by its ketone functional group and a bromophenyl substituent. This compound features a butanone backbone with a 4-bromophenyl group attached to the first carbon, and two methyl groups on the third carbon, contributing to its steric bulk. The presence of the bromine atom enhances its reactivity and can influence its physical properties, such as solubility and boiling point. Typically, compounds like this may exhibit moderate to high lipophilicity due to the aromatic bromine substituent, which can affect their behavior in biological systems and their potential applications in organic synthesis or medicinal chemistry. The compound may also participate in various chemical reactions, including nucleophilic substitutions and reductions, making it of interest in synthetic organic chemistry. Safety data should be consulted for handling, as halogenated compounds can pose health risks.
Formula:C12H15BrO
InChI:InChI=1S/C12H15BrO/c1-12(2,3)8-11(14)9-4-6-10(13)7-5-9/h4-7H,8H2,1-3H3
InChI key:InChIKey=RMSYXFAVKLWJDS-UHFFFAOYSA-N
SMILES:C(CC(C)(C)C)(=O)C1=CC=C(Br)C=C1
Synonyms:
  • 1-Butanone, 1-(4-bromophenyl)-3,3-dimethyl-
  • 1-(4-Bromophenyl)-3,3-dimethyl-1-butanone
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