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CAS 33577-98-9

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Methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate

Description:
Methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate, with the CAS number 33577-98-9, is an organic compound characterized by its ester functional group and a substituted aromatic ring. It features a methyl ester derived from benzoic acid, where the para position of the benzene ring is substituted with a 3-hydroxy-3-methylbut-1-ynyl group. This structure imparts unique chemical properties, including potential reactivity due to the presence of the alkyne functional group and the hydroxyl group, which can participate in hydrogen bonding. The compound is likely to be a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. It may exhibit moderate solubility in organic solvents and limited solubility in water due to its hydrophobic aromatic component. Methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate may have applications in organic synthesis, pharmaceuticals, or as a fragrance component, although specific uses would depend on further research and development. Safety data should be consulted for handling and storage guidelines.
Formula:C13H14O3
InChI:InChI=1/C13H14O3/c1-13(2,15)9-8-10-4-6-11(7-5-10)12(14)16-3/h4-7,15H,1-3H3
SMILES:CC(C)(C#Cc1ccc(cc1)C(=O)OC)O
Synonyms:
  • Methyl 4-(3-Hydroxy-3-Methylbut-1-Yn-1-Yl)Benzoate
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