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CAS 24277-44-9

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(R)-(-)-1-Phenylethyl isothiocyanate

Description:
(R)-(-)-1-Phenylethyl isothiocyanate is an organic compound characterized by its isothiocyanate functional group, which is derived from the corresponding thiourea. This compound features a phenyl group attached to a chiral carbon, making it optically active. It typically appears as a colorless to pale yellow liquid with a pungent odor, characteristic of isothiocyanates. The compound is known for its potential biological activities, including antimicrobial and anticancer properties, which have garnered interest in medicinal chemistry and agricultural applications. Its reactivity is attributed to the isothiocyanate group, allowing it to participate in various chemical reactions, including nucleophilic substitutions. The compound is soluble in organic solvents but has limited solubility in water. Safety precautions are necessary when handling this substance, as it can be irritating to the skin and respiratory system. Overall, (R)-(-)-1-Phenylethyl isothiocyanate serves as a valuable compound in both research and industrial contexts, particularly in the synthesis of other chemical entities.
Formula:C9H9NS
InChI:InChI=1/C9H9NS/c1-8(10-7-11)9-5-3-2-4-6-9/h2-6,8H,1H3/t8-/m1/s1
InChI key:InChIKey=QQCJPTVZIZVKEZ-MRVPVSSYSA-N
SMILES:[C@@H](N=C=S)(C)C1=CC=CC=C1
Synonyms:
  • (R)-(1-Isothiocyanatoethyl)benzene
  • (R)-α-Methylbenzyl isothiocyanate
  • Benzene, (1-isothiocyanatoethyl)-, (R)-
  • Benzene, [(1R)-1-isothiocyanatoethyl]-
  • Isothiocyanic acid, α-methylbenzyl ester, (R)-(-)-
  • [(1R)-1-Isothiocyanatoethyl]benzene
  • (R)-1-Phenylethyl isothiocyanate
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