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CAS 1451391-17-5

:

3-Chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

Description:
3-Chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol is an organic compound characterized by its phenolic structure, which includes a chlorine substituent and a boron-containing group. The presence of the chloro group indicates that it may exhibit reactivity typical of halogenated compounds, potentially participating in nucleophilic substitution reactions. The dioxaborolane moiety contributes to its unique properties, including potential applications in organic synthesis and medicinal chemistry, particularly in the context of boron chemistry. This compound may also exhibit solubility in organic solvents, influenced by the bulky tetramethyl groups that enhance its steric profile. Additionally, the phenolic hydroxyl group can engage in hydrogen bonding, affecting its physical properties such as boiling and melting points. Overall, this compound's structure suggests it may serve as a versatile intermediate in various chemical reactions, particularly in the development of pharmaceuticals or agrochemicals. Safety and handling precautions should be observed due to the presence of chlorine and the potential reactivity of the boron-containing group.
Formula:C12H16BClO3
InChI:InChI=1S/C12H16BClO3/c1-11(2)12(3,4)17-13(16-11)10-8(14)6-5-7-9(10)15/h5-7,15H,1-4H3
InChI key:InChIKey=BSFCYZUEPAANES-UHFFFAOYSA-N
SMILES:ClC1=C(C(O)=CC=C1)B2OC(C)(C)C(C)(C)O2
Synonyms:
  • Phenol, 3-chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • 3-Chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
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