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CAS 889858-09-7

:

1,1-Dimethylethyl 4-bromo-2-hydroxybenzoate

Description:
1,1-Dimethylethyl 4-bromo-2-hydroxybenzoate, with the CAS number 889858-09-7, is an organic compound that belongs to the class of benzoate esters. It features a benzoic acid derivative where a bromine atom is substituted at the para position relative to the hydroxyl group, which is located at the ortho position. The presence of the tert-butyl group (1,1-dimethylethyl) enhances its lipophilicity, potentially affecting its solubility and reactivity. This compound may exhibit biological activity due to the presence of the hydroxyl and bromine functional groups, which can influence its interaction with biological systems. It is typically used in research and development, particularly in the fields of medicinal chemistry and materials science. The compound's stability, reactivity, and potential applications can be influenced by factors such as pH, temperature, and the presence of other chemical species. Safety data should be consulted for handling and storage, as with any chemical substance.
Formula:C11H13BrO3
InChI:InChI=1S/C11H13BrO3/c1-11(2,3)15-10(14)8-5-4-7(12)6-9(8)13/h4-6,13H,1-3H3
InChI key:InChIKey=ZYXVOGMSFFKAMS-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)C1=C(O)C=C(Br)C=C1
Synonyms:
  • 1,1-Dimethylethyl 4-bromo-2-hydroxybenzoate
  • Benzoic acid, 4-bromo-2-hydroxy-, 1,1-dimethylethyl ester
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