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CAS 179104-32-6

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3-Chloro-2-[(1-methylethyl)thio]benzenamine

Description:
3-Chloro-2-[(1-methylethyl)thio]benzenamine, with the CAS number 179104-32-6, is an organic compound characterized by the presence of a chloro group and a thioether functional group attached to a benzene ring. This compound features a chloro substituent at the 3-position and an isopropylthio group at the 2-position of the benzene ring, which influences its chemical reactivity and physical properties. It is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. The presence of the amino group contributes to its potential as a nucleophile in various chemical reactions. Additionally, the compound may have applications in pharmaceuticals or agrochemicals, given the structural motifs that are often associated with biological activity. Safety data should be consulted for handling and storage, as compounds with halogen and amine functionalities can pose health risks. Overall, the unique combination of substituents in this compound makes it of interest in synthetic organic chemistry.
Formula:C9H12ClNS
InChI:InChI=1S/C9H12ClNS/c1-6(2)12-9-7(10)4-3-5-8(9)11/h3-6H,11H2,1-2H3
InChI key:InChIKey=HJYRCWDQTVQNJV-UHFFFAOYSA-N
SMILES:S(C(C)C)C1=C(Cl)C=CC=C1N
Synonyms:
  • Benzenamine, 3-chloro-2-[(1-methylethyl)thio]-
  • 3-Chloro-2-propan-2-ylsulfanylaniline
  • 3-Chloro-2-(propan-2-ylsulfanyl)aniline
  • 3-Chloro-2-(isopropylthio)aniline
  • 3-Chloro-2-[(1-methylethyl)thio]benzenamine
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