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CAS 147208-69-3

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Pyrrolidine, 2-[(3aS,4S,6S,7aR)-hexahydro-3a,5,5-trimethyl-4,6-methano-1,3,2-benzodioxaborol-2-yl]-, hydrochloride (1:1), (2R)-

Description:
Pyrrolidine, 2-[(3aS,4S,6S,7aR)-hexahydro-3a,5,5-trimethyl-4,6-methano-1,3,2-benzodioxaborol-2-yl]-, hydrochloride (1:1), (2R)- is a complex organic compound characterized by its unique bicyclic structure, which incorporates a pyrrolidine ring and a benzodioxaborole moiety. This compound is typically encountered as a hydrochloride salt, enhancing its solubility in polar solvents, which is beneficial for various applications in medicinal chemistry and drug formulation. The stereochemistry indicated by the (3aS,4S,6S,7aR) and (2R) designations suggests specific spatial arrangements of atoms, which can significantly influence the compound's biological activity and interaction with biological targets. The presence of multiple functional groups, including the boron-containing dioxaborole, may impart unique reactivity and properties, making it of interest in synthetic organic chemistry and potential therapeutic applications. As with many specialized compounds, safety data and handling precautions should be consulted, as they may pose specific health risks.
Formula:C14H24BNO2·ClH
InChI:InChI=1S/C14H24BNO2.ClH/c1-13(2)9-7-10(13)14(3)11(8-9)17-15(18-14)12-5-4-6-16-12;/h9-12,16H,4-8H2,1-3H3;1H/t9-,10-,11+,12-,14-;/m0./s1
InChI key:InChIKey=OVVMNBVQOPZMPY-AKDYBRCWSA-N
SMILES:C[C@]12[C@@]3(C(C)(C)[C@@](C3)(C[C@]1(OB(O2)[C@@H]4CCCN4)[H])[H])[H].Cl
Synonyms:
  • (R)-2-Pyrrolidineboronicacidpinanediolesterhydrochloride
  • (R)-BoroPro-(+)-Pinanediol-hydrochloride
  • 4,6-Methano-1,3,2-benzodioxaborole, pyrrolidine deriv.
  • Pyrrolidine, 2-(hexahydro-3a,5,5-trimethyl-4,6-methano-1,3,2-benzodioxaborol-2-yl)-, hydrochloride, [3aS-[2(S*),3aα,4β,6β,7aα]]-
  • Pyrrolidine, 2-[(3aS,4S,6S,7aR)-hexahydro-3a,5,5-trimethyl-4,6-methano-1,3,2-benzodioxaborol-2-yl]-, hydrochloride (1:1), (2R)-
  • Pyrrolidine, 2-[(3aS,4S,6S,7aR)-hexahydro-3a,5,5-trimethyl-4,6-methano-1,3,2-benzodioxaborol-2-yl]-, hydrochloride, (2R)-
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