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CAS 701269-86-5

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Ethyl α-ethoxy-2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzeneacetate

Description:
Ethyl α-ethoxy-2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzeneacetate, with CAS number 701269-86-5, is a synthetic organic compound characterized by its complex molecular structure, which includes an ethyl ester functional group and a dioxaborolane moiety. This compound features a difluorobenzene ring, which contributes to its unique electronic properties and potential reactivity. The presence of the ethoxy group enhances its solubility in organic solvents, making it suitable for various applications in organic synthesis and medicinal chemistry. The dioxaborolane unit is known for its utility in boron chemistry, particularly in cross-coupling reactions, which are essential in the formation of carbon-carbon bonds. Overall, this compound may exhibit interesting biological activity and could serve as a valuable intermediate in the development of pharmaceuticals or agrochemicals. Its stability, reactivity, and solubility characteristics make it a subject of interest in both academic and industrial research settings.
Formula:C18H25BF2O5
InChI:InChI=1S/C18H25BF2O5/c1-7-23-15(16(22)24-8-2)14-12(20)9-11(10-13(14)21)19-25-17(3,4)18(5,6)26-19/h9-10,15H,7-8H2,1-6H3
InChI key:InChIKey=FHOKBMVGULKTNO-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CC(F)=C(C(C(OCC)=O)OCC)C(F)=C2
Synonyms:
  • Benzeneacetic acid, α-ethoxy-2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester
  • Ethyl α-ethoxy-2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzeneacetate
  • [2,6-Difluoro-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)phenyl](ethoxy)acetic acid ethyl ester
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