CAS 1260379-40-5

2-Amino-4-(trifluoromethyl)benzenemethanethiol

Description:

2-Amino-4-(trifluoromethyl)benzenemethanethiol, identified by its CAS number 1260379-40-5, is an organic compound characterized by the presence of an amino group, a trifluoromethyl group, and a thiol group attached to a benzene ring. This compound features a benzene core with a methanethiol (-CH2SH) substituent, which imparts thiol characteristics, making it reactive and capable of forming disulfide bonds. The trifluoromethyl group (-CF3) enhances the compound's lipophilicity and can influence its electronic properties, potentially affecting its reactivity and interaction with biological systems. The amino group (-NH2) contributes to its basicity and can participate in hydrogen bonding, making the compound potentially useful in various chemical reactions, including nucleophilic substitutions. Overall, the unique combination of functional groups in 2-Amino-4-(trifluoromethyl)benzenemethanethiol suggests applications in pharmaceuticals, agrochemicals, and materials science, although specific applications would depend on further research into its properties and behavior in different environments.

Formula: C₈H₈F₃NS

InChI: InChI=1S/C8H8F3NS/c9-8(10,11)6-2-1-5(4-13)7(12)3-6/h1-3,13H,4,12H2

InChI key: InChIKey=MPTSYQSLGJKPSU-UHFFFAOYSA-N

SMILES: C(F)(F)(F)C1=CC(N)=C(CS)C=C1

Synonyms:

• Benzenemethanethiol, 2-amino-4-(trifluoromethyl)-
• 2-Amino-4-(trifluoromethyl)benzenemethanethiol