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CAS 850411-09-5

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Butanoic acid,4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-, ethyl ester

Description:
Butanoic acid, 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-, ethyl ester is an organic compound characterized by its ester functional group, which is derived from butanoic acid and an ethyl alcohol moiety. The presence of the boron-containing dioxaborolane group suggests potential applications in organic synthesis and medicinal chemistry, particularly in the context of drug delivery or as a building block in complex molecular architectures. This compound likely exhibits moderate polarity due to the ester and phenoxy groups, influencing its solubility in various organic solvents. The bulky tetramethyl dioxaborolane moiety may impart unique steric and electronic properties, potentially affecting its reactivity and interactions with biological targets. Additionally, the compound's structure indicates it may participate in hydrogen bonding and other intermolecular interactions, which could be relevant in its behavior in biological systems or during chemical reactions. Overall, this compound represents a specialized class of organic molecules with potential utility in various chemical and pharmaceutical applications.
Formula:C18H27BO5
InChI:InChI=1S/C18H27BO5/c1-6-21-16(20)11-8-12-22-15-10-7-9-14(13-15)19-23-17(2,3)18(4,5)24-19/h7,9-10,13H,6,8,11-12H2,1-5H3
InChI key:InChIKey=SWDLWVRPAGZQLZ-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CC(OCCCC(OCC)=O)=CC=C2
Synonyms:
  • 4-[3-(4,4,5,5-Tetramethyl-[1,3,2]Dioxaborolan-2-Yl)-Phenoxy]-Butyric Acid Ethyl Ester
  • Ethyl 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]butanoate
  • Butanoic acid, 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-, ethyl ester
  • Ethyl 4-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)butanoate（WS203851）
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