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CAS 204588-77-2

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Benzyl 2,2-dimethylbut-3-ynoate

Description:
Benzyl 2,2-dimethylbut-3-ynoate is an organic compound characterized by its ester functional group, which is derived from the reaction of a carboxylic acid and an alcohol. This compound features a benzyl group, which contributes to its aromatic properties, and a 2,2-dimethylbut-3-ynoate moiety, indicating the presence of a terminal alkyne due to the triple bond between carbon atoms. The structure suggests that it has a relatively high degree of stability due to the resonance stabilization provided by the benzyl group. It is likely to be a colorless to pale yellow liquid with a distinct odor, typical of many esters. The compound may exhibit moderate solubility in organic solvents and limited solubility in water, reflecting the hydrophobic nature of the aromatic and aliphatic components. Additionally, it may participate in various chemical reactions, including nucleophilic additions and polymerization, making it of interest in organic synthesis and materials science. Safety data should be consulted for handling and storage, as with all chemical substances.
Formula:C13H14O2
InChI:InChI=1/C13H14O2/c1-4-13(2,3)12(14)15-10-11-8-6-5-7-9-11/h1,5-9H,10H2,2-3H3
SMILES:C#CC(C)(C)C(=O)OCc1ccccc1
Synonyms:
  • 3-Butynoic Acid, 2,2-Dimethyl-, Phenylmethyl Ester
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