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CAS 2696-33-5

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4-(1,1-Dimethyl-4-penten-2-yn-1-yl)phenol

Description:
4-(1,1-Dimethyl-4-penten-2-yn-1-yl)phenol, with the CAS number 2696-33-5, is an organic compound characterized by its phenolic structure, which includes a hydroxyl group (-OH) attached to a phenyl ring. This compound features a unique aliphatic side chain that includes a dimethyl group and a terminal alkyne, contributing to its reactivity and potential applications in organic synthesis. It is typically a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. The presence of the alkyne functionality suggests that it may participate in various chemical reactions, such as nucleophilic additions or cycloadditions. Additionally, the compound may exhibit biological activity, making it of interest in medicinal chemistry. Its solubility characteristics can vary, often being more soluble in organic solvents than in water. Safety data should be consulted for handling, as phenolic compounds can be toxic and irritative. Overall, this compound's unique structure and properties make it a subject of interest in both industrial and research applications.
Formula:C13H14O
InChI:InChI=1S/C13H14O/c1-4-5-10-13(2,3)11-6-8-12(14)9-7-11/h4,6-9,14H,1H2,2-3H3
InChI key:InChIKey=QRCZSLMYYOGMQQ-UHFFFAOYSA-N
SMILES:C(C#CC=C)(C)(C)C1=CC=C(O)C=C1
Synonyms:
  • 4-(1,1-Dimethyl-4-penten-2-yn-1-yl)phenol
  • Dimethyl(vinylethynyl)(p-hydroxyphenyl)methane
  • Phenol, p-(1,1-dimethyl-4-penten-2-ynyl)-
  • Phenol, 4-(1,1-dimethyl-4-penten-2-yn-1-yl)-
  • Phenol, 4-(1,1-dimethyl-4-penten-2-ynyl)-
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