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CAS 71209-71-7

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1-[4-(1,1-Dimethylethyl)phenyl]-1-propanone

Description:
1-[4-(1,1-Dimethylethyl)phenyl]-1-propanone, also known as benzyl isobutyl ketone, is an organic compound characterized by its ketone functional group. It features a propanone backbone with a tert-butyl group attached to a phenyl ring, which contributes to its hydrophobic nature. This compound typically appears as 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 characteristics. The compound is primarily used in the synthesis of various organic compounds and as an intermediate in the production of fragrances and flavoring agents. Additionally, it may serve as a photoinitiator in polymer chemistry. Safety data indicates that it should be handled with care, as it may cause irritation upon contact with skin or eyes and should be used in well-ventilated areas to avoid inhalation of vapors. Proper storage in a cool, dry place away from incompatible substances is recommended to maintain its stability.
Formula:C13H18O
InChI:InChI=1S/C13H18O/c1-5-12(14)10-6-8-11(9-7-10)13(2,3)4/h6-9H,5H2,1-4H3
InChI key:InChIKey=AQNYEAINONORRY-UHFFFAOYSA-N
SMILES:C(C)(C)(C)C1=CC=C(C(CC)=O)C=C1
Synonyms:
  • 1-(4-tert-Butylphenyl)propan-1-one
  • 1-Propanone, 1-[4-(1,1-dimethylethyl)phenyl]-
  • 1-[4-(1,1-Dimethylethyl)phenyl]-1-propanone
  • 1-[4-(Tert-Butyl)Phenyl]Propan-1-One
  • 4-(1,1-Dimethylethyl)propiophenone
  • 4-tert-Butylpropiophenone
  • 4tert-Butylpropiophenone
  • Propiophenone, 4′-tert-butyl-
  • p-tert-Butylpropiophenone
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