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CAS 18967-42-5

:

Benzene, 1,2-dichloro-4-(isothiocyanatomethyl)-

Description:
Benzene, 1,2-dichloro-4-(isothiocyanatomethyl)-, also known by its CAS number 18967-42-5, is an organic compound characterized by a benzene ring substituted with two chlorine atoms and an isothiocyanatomethyl group. This compound features a dichlorobenzene structure, which contributes to its chemical stability and potential reactivity. The presence of the isothiocyanate functional group (-N=C=S) indicates that it may exhibit biological activity, as isothiocyanates are known for their roles in various chemical reactions and potential applications in pharmaceuticals and agrochemicals. The dichloro substitutions can influence the compound's solubility, volatility, and reactivity, making it important in both synthetic and environmental chemistry contexts. Additionally, the compound may pose certain health and environmental risks, typical of chlorinated aromatic compounds, necessitating careful handling and assessment of its safety profile. Overall, this compound exemplifies the complexity and utility of halogenated organic molecules in chemical research and industry.
Formula:C8H5Cl2NS
InChI:InChI=1/C8H5Cl2NS/c9-7-2-1-6(3-8(7)10)4-11-5-12/h1-3H,4H2
InChI key:InChIKey=DPSSHXWTNIGVMQ-UHFFFAOYSA-N
SMILES:C(N=C=S)C1=CC(Cl)=C(Cl)C=C1
Synonyms:
  • 1,2-Dichloro-4-(Isothiocyanatomethyl)Benzene
  • 3,4-Dichlorobenzyl isothiocyanate
  • Benzene, 1,2-dichloro-4-(isothiocyanatomethyl)-
  • Isothiocyanic acid, 3,4-dichlorobenzyl ester
  • NSC 221245
  • Toluene, 3,4-dichloro-α-isothiocyanato-
  • isothiocyanicacid,(3,4-dichlorobenzyl)ester
  • 3,4-Dichlorobenzyl isothiocyanate-97%
  • Dextropropoxyphene Hydrochloride Impurity 9
  • 3,4-Dichlorobenzyl isothiocyate, 98%
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