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CAS 342002-80-6

:

1-(1-Methylethyl) 3-boronobenzoate

Description:
1-(1-Methylethyl) 3-boronobenzoate, identified by its CAS number 342002-80-6, is an organic compound that features a boron atom bonded to a benzoate moiety. This compound typically exhibits characteristics associated with both boron and aromatic compounds. The presence of the isopropyl group (1-methylethyl) contributes to its hydrophobic nature, influencing its solubility in organic solvents rather than in water. The boron atom in the structure can participate in coordination chemistry, making it useful in various applications, including catalysis and materials science. Additionally, the benzoate group can engage in π-π stacking interactions, which may affect the compound's physical properties, such as melting point and boiling point. The compound's reactivity may also be influenced by the electron-withdrawing nature of the boron atom, potentially making it a candidate for further chemical transformations. Overall, 1-(1-Methylethyl) 3-boronobenzoate is a versatile compound with potential applications in organic synthesis and materials development.
Formula:C10H13BO4
InChI:InChI=1S/C10H13BO4/c1-7(2)15-10(12)8-4-3-5-9(6-8)11(13)14/h3-7,13-14H,1-2H3
InChI key:InChIKey=HXVODQWMURGQMP-UHFFFAOYSA-N
SMILES:C(OC(C)C)(=O)C1=CC(B(O)O)=CC=C1
Synonyms:
  • 1-(1-Methylethyl) 3-boronobenzoate
  • 3-Isopropoxycarbonylphenylboronic acid
  • 4-(2H-tetrazol-5-yl)benzaldehyde
  • Benzoic acid, 3-borono-, 1-(1-methylethyl) ester
  • [3-(Isopropoxycarbonyl)phenyl]boronic acid
  • [3-[(Propan-2-yloxy)carbonyl]phenyl]boronic acid
  • {3-[(1-Methylethoxy)Carbonyl]Phenyl}Boronic Acid
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