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CAS 1402238-34-9

:

Benzoic acid, 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester

Description:
Benzoic acid, 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester, identified by CAS number 1402238-34-9, is an organic compound characterized by its complex structure that includes a benzoic acid moiety, a nitro group, and a boronate ester. This compound typically exhibits properties associated with both aromatic compounds and esters, such as moderate solubility in organic solvents and potential reactivity due to the presence of the nitro group. The boronate group may confer unique reactivity, particularly in cross-coupling reactions, making it of interest in synthetic organic chemistry. The presence of the nitro group can influence the compound's electronic properties, potentially affecting its reactivity and interactions with other chemical species. Additionally, the compound may exhibit specific biological activities, which could be relevant in pharmaceutical applications. Overall, its unique structural features suggest a range of potential applications in organic synthesis and materials science.
Formula:C14H18BNO6
InChI:InChI=1S/C14H18BNO6/c1-13(2)14(3,4)22-15(21-13)9-6-7-10(12(17)20-5)11(8-9)16(18)19/h6-8H,1-5H3
InChI key:InChIKey=YXJOPYXGQATVOC-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CC(N(=O)=O)=C(C(OC)=O)C=C2
Synonyms:
  • Methyl 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
  • Benzoic acid, 2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
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