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CAS 787591-43-9

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2-(3-Isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Description:
2-(3-Isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, with the CAS number 787591-43-9, is a chemical compound characterized by its unique structure that includes a dioxaborolane ring and an isocyanate functional group. This compound typically exhibits properties associated with both boron-containing compounds and isocyanates, such as reactivity towards nucleophiles and potential applications in organic synthesis and materials science. The presence of the isocyanate group suggests that it can participate in reactions to form ureas or carbamates, making it useful in the development of polymers and pharmaceuticals. Additionally, the dioxaborolane moiety may contribute to its stability and solubility in organic solvents. Overall, this compound is of interest in various fields, including medicinal chemistry and polymer science, due to its functional versatility and potential for further chemical modifications. Safety precautions should be observed when handling this compound, as isocyanates can be hazardous.
Formula:C13H16BNO3
InChI:InChI=1/C13H16BNO3/c1-12(2)13(3,4)18-14(17-12)10-6-5-7-11(8-10)15-9-16/h5-8H,1-4H3
InChI key:InChIKey=VSAATWKRRDGVOD-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CC(N=C=O)=CC=C2
Synonyms:
  • 2-(3-Isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
  • 1,3,2-Dioxaborolane, 2-(3-isocyanatophenyl)-4,4,5,5-tetramethyl-
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