| Identification | Back Directory | [Name]
3 6-DICHLORO-1 2-BENZENEDITHIOL 95 | [CAS]
87314-49-6 | [Synonyms]
3,6-DICHLORO-BENZENE-1,2-DITHIOL
1,2-Benzenedithiol, 3,6-dichloro-
3 6-DICHLORO-1 2-BENZENEDITHIOL 95
3 6-DICHLORO-1 2-BENZENEDITHIOL 95% | [Molecular Formula]
C6H4Cl2S2 | [MDL Number]
MFCD00216665 | [MOL File]
87314-49-6.mol | [Molecular Weight]
211.13 |
| Chemical Properties | Back Directory | [Melting point ]
58-60°C (lit.) | [Boiling point ]
314.9±37.0 °C(Predicted) | [density ]
1.523±0.06 g/cm3(Predicted) | [storage temp. ]
room temp | [form ]
powder, crystals or chunks | [pka]
4.40±0.50(Predicted) | [InChI]
InChI=1S/C6H4Cl2S2/c7-3-1-2-4(8)6(10)5(3)9/h1-2,9-10H | [InChIKey]
AJCUDWCLDWDLNY-UHFFFAOYSA-N | [SMILES]
C1(S)=C(Cl)C=CC(Cl)=C1S |
| Hazard Information | Back Directory | [Uses]
3,6-Dichloro-1,2-benzenedithiol is a stain/dye. Dyes and metabolites. | [Application]
3,6-Dichloro-1,2-benzenedithiol has been used as a ligand in thiolate complexes and a series of homo-chalcogenide and mixed-chalcogenide ligand complexes. For example, Direct reaction between Cu(ClO4)2 and 3,6-dichloro-1,2-benzenedithiol (HSC6H2Cl2SH) in the presence of basic salts leads to a series of bis(dithiolato)cuprate(III) [Cu(SC6H2Cl2S)2]? coordination complexes and coordination polymers. In addition, One-pot reactions between Ni(II), Pd(II), or Pt(II) salts and 3,6-dichloro-1,2-benzenedithiol (HSC6H2Cl2SH) in KOH medium under argon lead to a series of bis-dithiolene coordination polymer[1-2].
| [References]
[1] Amo-Ochoa, Pilar et al. “Copper dithiolene [Cu(SC6H2Cl2S)2]? units connected to alkaline/copper complexes: from ionic assemblies to discrete molecular entities and coordination polymers?.” CrystEngComm 6 (2018): 957–963.
[2] Delgado, Esther et al. “Unprecedented layered coordination polymers of dithiolene group 10 metals: magnetic and electrical properties?.” Dalton Transactions 15 (2016): 6696–6701. |
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