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CAS 13988-67-5

:

4,4-Dimethyl-1-phenyl-1,3-pentanedione

Description:
4,4-Dimethyl-1-phenyl-1,3-pentanedione, with the CAS number 13988-67-5, is an organic compound characterized by its diketone structure, featuring two carbonyl groups (C=O) flanked by a phenyl group and two methyl groups. This compound typically appears as a yellow to orange crystalline solid and is known for its ability to chelate metal ions, making it useful in various applications, including coordination chemistry and as a reagent in organic synthesis. It exhibits moderate solubility in organic solvents such as ethanol and acetone, while being less soluble in water due to its hydrophobic characteristics. The presence of the phenyl group contributes to its aromatic properties, influencing its reactivity and stability. Additionally, 4,4-Dimethyl-1-phenyl-1,3-pentanedione can undergo various chemical reactions, including condensation and oxidation, making it a versatile compound in synthetic organic chemistry. Safety precautions should be taken when handling this substance, as it may pose health risks if inhaled or ingested.
Formula:C13H16O2
InChI:InChI=1S/C13H16O2/c1-13(2,3)12(15)9-11(14)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChI key:InChIKey=HORVLKADAZQYRS-UHFFFAOYSA-N
SMILES:C(CC(C(C)(C)C)=O)(=O)C1=CC=CC=C1
Synonyms:
  • 1,3-Pentanedione, 4,4-dimethyl-1-phenyl-
  • 1-Benzoylpinacolone~alpha-Pivaloylacetophenone
  • 1-Phenyl-4,4-dimethyl-1,3-pentanedione
  • 2,2-Dimethyl-5-phenyl-3,5-pentanedione
  • 4,4-Dimethyl-1-phenyl-1,3-pentanedione
  • 5,5-Dimethyl-1-phenylpentane-2,4-dione
  • Benzoylpivaloylmethane
  • Pivaloylbenzoylmethane
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