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CAS 878289-42-0

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Boronic acid, B-[2-(1-pyrrolidinylmethyl)phenyl]-, hydrate (1:1)

Description:
Boronic acid, specifically B-[2-(1-pyrrolidinylmethyl)phenyl]-, hydrate (1:1), is an organoboron compound characterized by the presence of a boronic acid functional group attached to a phenyl ring that is further substituted with a pyrrolidine moiety. This compound typically exhibits properties associated with boronic acids, such as the ability to form reversible covalent bonds with diols, making it useful in various applications, including organic synthesis and medicinal chemistry. The presence of the pyrrolidine group may enhance its solubility and reactivity, potentially allowing for interactions with biological targets. As a hydrate, it contains water molecules in its structure, which can influence its stability and solubility in different solvents. The compound is likely to be a white to off-white solid, and its reactivity can be attributed to the boron atom's ability to accept electron pairs, making it a versatile building block in the synthesis of complex organic molecules. Safety data should be consulted for handling and storage, as boronic acids can have specific hazards associated with them.
Formula:C11H16BNO2·H2O
InChI:InChI=1S/C11H16BNO2.H2O/c14-12(15)11-6-2-1-5-10(11)9-13-7-3-4-8-13;/h1-2,5-6,14-15H,3-4,7-9H2;1H2
InChI key:InChIKey=QVQSFEZAWDKCPV-UHFFFAOYSA-N
SMILES:C(C1=C(B(O)O)C=CC=C1)N2CCCC2.O
Synonyms:
  • Boronic acid, [2-(1-pyrrolidinylmethyl)phenyl]-, monohydrate
  • Boronic acid, B-[2-(1-pyrrolidinylmethyl)phenyl]-, hydrate (1:1)
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