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CAS 175205-39-7

:

4-Fluoro-2-isothiocyanato-1-methylbenzene

Description:
4-Fluoro-2-isothiocyanato-1-methylbenzene, also known by its CAS number 175205-39-7, is an organic compound characterized by the presence of a fluorine atom, an isothiocyanate functional group, and a methyl group attached to a benzene ring. This compound features a fluorobenzene structure, where the fluorine substituent is located at the para position relative to the isothiocyanate group, which is attached at the ortho position to the methyl group. The isothiocyanate group (-N=C=S) is known for its reactivity, particularly in nucleophilic addition reactions, and can serve as a versatile building block in organic synthesis. The presence of the fluorine atom can influence the compound's electronic properties, potentially enhancing its reactivity and solubility in various solvents. Additionally, the compound may exhibit biological activity, making it of interest in medicinal chemistry and agrochemical applications. As with many isothiocyanates, it may also possess distinct odor characteristics and should be handled with care due to potential toxicity.
Formula:C8H6FNS
InChI:InChI=1S/C8H6FNS/c1-6-2-3-7(9)4-8(6)10-5-11/h2-4H,1H3
InChI key:InChIKey=QVCYTKXGZLOVFA-UHFFFAOYSA-N
SMILES:N(=C=S)C1=C(C)C=CC(F)=C1
Synonyms:
  • 2-Methyl-5-Fluorophenyl Isothiocyanate
  • 4-Fluoro-2-isothiocyanato-1-methylbenzene
  • Benzene, 4-fluoro-2-isothiocyanato-1-methyl-
  • 5-Fluoro-2-methylphenyl isothiocyanate
  • 5-FLUORO-O-TOLYL ISOTHIOCYANATE
  • Benzene, 4-fluoro-2-isothiocyanato-1-methyl-(9CI)
  • 5-Fluoro-2-methylphenylisothiocyanate97%
  • 5-Fluoro-2-methylphenyl isothiocyanate 97%
  • ISOTHIOCYANIC ACID 5-FLUORO-O-TOLYL ESTER
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