1,2-Benzenedithiol, 3,4,5,6-tetrachloro-
Basic information
- CAS
13801-50-8- Standard SMILES
Sc1c(S)c(Cl)c(Cl)c(Cl)c1Cl- InChIKey
MSSNSTXFTUNKQH-UHFFFAOYSA-N- Molecular formula
- C6H2Cl4S2
- Average molar mass
- 280 g/mol
- Monoisotopic mass
- 277.835203
Names & identifiers
- Preferred name
- 1,2-Benzenedithiol, 3,4,5,6-tetrachloro-
- IUPAC
- 3,4,5,6-tetrachlorobenzene-1,2-dithiol
- English name
- 3,4,5,6-Tetrachloro-1,2-benzenedithiol
- Molecular formula
- C6H2Cl4S2
- Molecular weight
- 280.02
Names & synonyms
13801-50-8Tetrachloro-o-benzenedithiol1,2-Benzenedithiol, 3,4,5,6-tetrachloro-DTXSID1065639RefChem:411270DTXCID20344653,4,5,6-tetrachlorobenzene-1,2-dithioltetrachlorobenzene-1,2-dithiol3,4,5,6-Tetrachloro-1,2-benzenedithiolSCHEMBL1425050SCHEMBL31663683MSSNSTXFTUNKQH-UHFFFAOYSA-N
Show more names
D88028
Database identifiers
- CAS
13801-50-8- PubChem CID
- 83740
- DTXSID
DTXSID1065639- Nikkaji
- J421.896E
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 150
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,2-Benzenedithiol, 3,4,5,6-tetrachloro- (13801-50-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,2-Benzenedithiol, 3,4,5,6-tetrachloro-: INACTIVE
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…