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CAS 351068-85-4

:

(αS)-α-(Chloromethyl)-4-methylbenzenemethanol

Description:
(αS)-α-(Chloromethyl)-4-methylbenzenemethanol, with the CAS number 351068-85-4, is an organic compound characterized by its chloromethyl and hydroxymethyl functional groups attached to a substituted aromatic ring. This compound features a chiral center, which contributes to its stereochemistry, specifically the (αS) configuration. The presence of the chloromethyl group indicates potential reactivity, particularly in nucleophilic substitution reactions, while the hydroxymethyl group can participate in hydrogen bonding and may influence the compound's solubility and reactivity. The 4-methyl substitution on the benzene ring affects the electronic distribution and steric hindrance, which can impact the compound's physical properties, such as boiling point and melting point. Additionally, the compound may exhibit biological activity, making it of interest in pharmaceutical research. Its synthesis and applications could be explored in various fields, including medicinal chemistry and materials science, due to the functional groups present that allow for further chemical modifications.
Formula:C9H11ClO
InChI:InChI=1S/C9H11ClO/c1-7-2-4-8(5-3-7)9(11)6-10/h2-5,9,11H,6H2,1H3/t9-/m1/s1
InChI key:InChIKey=HNIOYEPFDGBZMW-SECBINFHSA-N
SMILES:[C@H](CCl)(O)C1=CC=C(C)C=C1
Synonyms:
  • Benzenemethanol, α-(chloromethyl)-4-methyl-, (αS)-
  • (S)-(+)-2-Chloro-1-(4-methylphenyl)ethanol
  • (1S)-2-Chloro-1-(4-methylphenyl)ethan-1-ol
  • (αS)-α-(Chloromethyl)-4-methylbenzenemethanol
  • TB-1955
  • (S)-2-Chloro-1-(p-tolyl)ethan-1-ol
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