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CS-W001157 4
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2,6-Dichlorobenzenethiol

  • CAS No. 24966-39-0

  • Cat. No. CS-0076836
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

2,6-Dichlorobenzenethiol|CS-0076836

Structure of 24966-39-0

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General Information

  • CAS No. 24966-39-0
  • Cat. No. CS-0076836
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄Cl₂S
  • Molecular Weight 179.07
  • Synonym(s) Benzenethiol, 2,6-dichloro-
  • SMILES SC(C(Cl)=CC=C1)=C1Cl

Description

2,6-Dichlorobenzenethiol features a thiol group flanked by two chlorine atoms at the 2 and 6 positions of the benzene ring, imparting enhanced electrophilic character and stability. This configuration enables selective functionalization in cross-coupling reactions and offers robust performance under standard bench conditions.

Application

2,6-Dichlorobenzenethiol serves as a versatile building block in synthetic organic chemistry, enabling the construction of thioether-linked heterocycles and bioactive scaffolds. Its ortho-chlorine substituents enhance electrophilic reactivity while maintaining bench stability, facilitating efficient coupling reactions with nucleophiles and transition-metal catalysts. The molecule's functional group tolerance supports diverse transformations in medicinal chemistry and materials science applications.

Synthesis

  • Route1

    References

    • Journal of Heterocyclic Chemistry, , vol. 11, p. 257,258-262

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301+H311+H331-H315-H319
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.2821
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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