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CAS 154825-94-2

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Methyl α,α-dimethyl-4-[4-[(methylsulfonyl)oxy]-1-butyn-1-yl]benzeneacetate

Description:
Methyl α,α-dimethyl-4-[4-[(methylsulfonyl)oxy]-1-butyn-1-yl]benzeneacetate, with CAS number 154825-94-2, is a synthetic organic compound characterized by its complex structure, which includes a benzene ring, an ester functional group, and a sulfonate moiety. This compound features a methylsulfonyl group that enhances its solubility and reactivity, making it useful in various chemical applications. The presence of the butynyl group indicates potential for further chemical transformations, particularly in organic synthesis. Its molecular structure suggests it may exhibit specific biological activities, which could be of interest in pharmaceutical research. The compound is likely to be a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. As with many organic compounds, it is important to handle it with care, considering potential toxicity and environmental impact. Proper safety measures should be observed when working with this substance in laboratory settings.
Formula:C16H20O5S
InChI:InChI=1S/C16H20O5S/c1-16(2,15(17)20-3)14-10-8-13(9-11-14)7-5-6-12-21-22(4,18)19/h8-11H,6,12H2,1-4H3
InChI key:InChIKey=FJJVTPFUPQUZBM-UHFFFAOYSA-N
SMILES:C(C(OC)=O)(C)(C)C1=CC=C(C#CCCOS(C)(=O)=O)C=C1
Synonyms:
  • Methyl α,α-dimethyl-4-[4-[(methylsulfonyl)oxy]-1-butyn-1-yl]benzeneacetate
  • Benzeneacetic acid, α,α-dimethyl-4-[4-[(methylsulfonyl)oxy]-1-butynyl]-, methyl ester
  • Benzeneacetic acid, α,α-dimethyl-4-[4-[(methylsulfonyl)oxy]-1-butyn-1-yl]-, methyl ester
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