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CAS 336105-43-2

:

Benzenemethanamine, 4-bromo-α-(trifluoromethyl)-, hydrochloride (1:1), (αS)-

Description:
Benzenemethanamine, 4-bromo-α-(trifluoromethyl)-, hydrochloride (1:1), (αS)-, with the CAS number 336105-43-2, is a chemical compound characterized by its structural features that include a benzene ring, a bromine substituent at the para position, and a trifluoromethyl group attached to the alpha carbon of the amine. This compound exists as a hydrochloride salt, which enhances its solubility in water and may influence its biological activity. The presence of the trifluoromethyl group typically imparts unique electronic properties, potentially affecting the compound's reactivity and interaction with biological targets. As an amine, it can participate in various chemical reactions, including nucleophilic substitutions and formation of amides. The specific stereochemistry indicated by (αS)- suggests that the compound has a defined three-dimensional arrangement, which can be crucial for its pharmacological properties. Overall, this compound may be of interest in medicinal chemistry and material science due to its unique functional groups and potential applications.
Formula:C8H7BrF3N·ClH
InChI:InChI=1S/C8H7BrF3N.ClH/c9-6-3-1-5(2-4-6)7(13)8(10,11)12;/h1-4,7H,13H2;1H/t7-;/m0./s1
InChI key:InChIKey=XESDERGPILUSRV-FJXQXJEOSA-N
SMILES:[C@H](C(F)(F)F)(N)C1=CC=C(Br)C=C1.Cl
Synonyms:
  • (s)-1-(4-Bromophenyl)-2,2,2-trifluoroethylamine hydrochloride
  • Benzenemethanamine, 4-bromo-α-(trifluoromethyl)-, hydrochloride, (αS)-
  • Benzenemethanamine,4-bromo-a-(trifluoromethyl)-,hydrochloride, (aS)-(9CI)
  • Benzenemethanamine, 4-bromo-α-(trifluoromethyl)-, hydrochloride (1:1), (αS)-
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