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CAS 1198615-87-0

:

Ethyl 2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate

Description:
Ethyl 2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate is an organic compound characterized by its complex structure, which includes a benzoate moiety and a dioxaborolane group. The presence of the ethyl ester functional group contributes to its solubility in organic solvents, making it useful in various chemical applications. The dioxaborolane component is notable for its ability to participate in boron chemistry, often serving as a versatile building block in organic synthesis, particularly in the formation of carbon-boron bonds. This compound may exhibit properties such as moderate volatility and stability under standard conditions, although specific reactivity can depend on the surrounding environment and functional groups present. Its unique structure suggests potential applications in medicinal chemistry, materials science, and as an intermediate in the synthesis of more complex organic molecules. Safety data and handling precautions should be observed, as with any chemical substance, to ensure safe usage in laboratory settings.
Formula:C16H23BO4
InChI:InChI=1S/C16H23BO4/c1-7-19-14(18)12-9-8-10-13(11(12)2)17-20-15(3,4)16(5,6)21-17/h8-10H,7H2,1-6H3
InChI key:InChIKey=JZZPYKYHYBXWEP-UHFFFAOYSA-N
SMILES:CC1=C(C=CC=C1C(OCC)=O)B2OC(C)(C)C(C)(C)O2
Synonyms:
  • Ethyl 2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
  • Benzoic acid, 2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester
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