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CAS 1158735-27-3

:

5-(Bromomethyl)-3-(3-bromophenyl)isoxazole

Description:
5-(Bromomethyl)-3-(3-bromophenyl)isoxazole is a chemical compound characterized by its isoxazole ring, which is a five-membered heterocyclic structure containing both nitrogen and oxygen atoms. The presence of bromomethyl and bromophenyl substituents indicates that the compound has significant halogenation, which can influence its reactivity and biological activity. The bromine atoms can enhance the compound's lipophilicity and may also play a role in its potential as a pharmacophore in medicinal chemistry. Isoxazoles are known for their diverse applications, including in pharmaceuticals and agrochemicals, due to their ability to interact with various biological targets. The specific arrangement of the bromine substituents can affect the compound's electronic properties and steric hindrance, which are critical for its reactivity and interaction with other molecules. Overall, this compound's unique structure and substituents suggest potential utility in research and development within organic synthesis and drug discovery.
Formula:C10H7Br2NO
InChI:InChI=1S/C10H7Br2NO/c11-6-9-5-10(13-14-9)7-2-1-3-8(12)4-7/h1-5H,6H2
InChI key:InChIKey=OCTOWVMASYVELT-UHFFFAOYSA-N
SMILES:C(Br)C1=CC(=NO1)C2=CC(Br)=CC=C2
Synonyms:
  • 5-(Bromomethyl)-3-(3-bromophenyl)isoxazole
  • Isoxazole, 5-(bromomethyl)-3-(3-bromophenyl)-
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