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CAS 23039-28-3

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3-(1,1-Dimethylethyl)benzaldehyde

Description:
3-(1,1-Dimethylethyl)benzaldehyde, also known as p-tert-butylbenzaldehyde, is an aromatic aldehyde characterized by the presence of a benzene ring substituted with a tert-butyl group and an aldehyde functional group. Its molecular formula is C11H14O, indicating it contains 11 carbon atoms, 14 hydrogen atoms, and one oxygen atom. This compound typically appears as a colorless to pale yellow liquid with a distinctive aromatic odor. It is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic tert-butyl group. The compound is used in organic synthesis and as a fragrance component in various products. Its reactivity is primarily attributed to the aldehyde functional group, which can participate in various chemical reactions, including oxidation and condensation. Safety considerations include handling it in a well-ventilated area and using appropriate personal protective equipment, as it may cause irritation to the skin and eyes.
Formula:C11H14O
InChI:InChI=1S/C11H14O/c1-11(2,3)10-6-4-5-9(7-10)8-12/h4-8H,1-3H3
InChI key:InChIKey=HKEQMVXZDQLSDY-UHFFFAOYSA-N
SMILES:C(C)(C)(C)C1=CC(C=O)=CC=C1
Synonyms:
  • 3-(1,1-Dimethylethyl)benzaldehyde
  • Benzaldehyde, 3-(1,1-dimethylethyl)-
  • Benzaldehyde, m-tert-butyl-
  • m-tert-Butylbenzaldehyde
  • 3-tert-Butylbenzaldehyde
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