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CAS 1131587-57-9

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Ethyl 2-amino-5-iodo-4-(trifluoromethyl)benzoate

Description:
Ethyl 2-amino-5-iodo-4-(trifluoromethyl)benzoate is a chemical compound characterized by its complex structure, which includes an ethyl ester group, an amino group, and a trifluoromethyl substituent on a benzoate ring. The presence of the iodine atom and the trifluoromethyl group contributes to its unique reactivity and potential applications in organic synthesis and medicinal chemistry. This compound is likely to exhibit moderate to high lipophilicity due to the aromatic system and the trifluoromethyl group, which can influence its biological activity and solubility in organic solvents. The amino group may participate in hydrogen bonding, affecting its interaction with biological targets. Additionally, the compound's iodine atom can serve as a site for further chemical modifications, making it a valuable intermediate in the synthesis of more complex molecules. Overall, Ethyl 2-amino-5-iodo-4-(trifluoromethyl)benzoate is of interest in research fields that explore fluorinated compounds and their applications in pharmaceuticals and agrochemicals.
Formula:C10H9F3INO2
InChI:InChI=1S/C10H9F3INO2/c1-2-17-9(16)5-3-7(14)6(4-8(5)15)10(11,12)13/h3-4H,2,15H2,1H3
InChI key:InChIKey=GHMWRKWXZRXFOY-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=C(N)C=C(C(F)(F)F)C(I)=C1
Synonyms:
  • Ethyl 2-amino-5-iodo-4-(trifluoromethyl)benzoate
  • Benzoic acid, 2-amino-5-iodo-4-(trifluoromethyl)-, ethyl ester
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