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CAS 1260829-36-4

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Methyl 4-amino-3-bromo-5-(trifluoromethoxy)benzoate

Description:
Methyl 4-amino-3-bromo-5-(trifluoromethoxy)benzoate is an organic compound characterized by its complex structure, which includes a benzoate moiety substituted with various functional groups. The presence of an amino group (-NH2) indicates potential basicity and reactivity, particularly in nucleophilic substitution reactions. The bromine atom introduces electrophilic characteristics, making it a useful intermediate in organic synthesis. The trifluoromethoxy group (-OCF3) enhances the compound's lipophilicity and can influence its biological activity, often imparting unique properties such as increased metabolic stability. This compound is likely to exhibit moderate solubility in organic solvents and may have limited solubility in water due to its hydrophobic trifluoromethoxy group. Its molecular structure suggests potential applications in pharmaceuticals or agrochemicals, particularly in the development of compounds with specific biological activities. Overall, Methyl 4-amino-3-bromo-5-(trifluoromethoxy)benzoate is a versatile compound with significant implications in synthetic chemistry and medicinal applications.
Formula:C9H7BrF3NO3
InChI:InChI=1S/C9H7BrF3NO3/c1-16-8(15)4-2-5(10)7(14)6(3-4)17-9(11,12)13/h2-3H,14H2,1H3
InChI key:InChIKey=HKMMWDHVTNEYRK-UHFFFAOYSA-N
SMILES:O(C(F)(F)F)C1=CC(C(OC)=O)=CC(Br)=C1N
Synonyms:
  • Methyl 4-amino-3-bromo-5-(trifluoromethoxy)benzoate
  • Benzoic acid, 4-amino-3-bromo-5-(trifluoromethoxy)-, methyl ester
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