CID 359775
Basic information
- CAS
742000-80-2- Standard SMILES
Clc1cc2ns[s+]c2cc1Cl- InChIKey
YOGWBEYBWTXLGE-UHFFFAOYSA-N- Molecular formula
- C6H2Cl2NS2+
- Average molar mass
- 223.1 g/mol
- Monoisotopic mass
- 221.9005718
Names & identifiers
- Preferred name
- CID 359775
- IUPAC
- 5,6-dichloro-1,2,3-benzodithiazol-1-ium
Names & synonyms
5,6-dichloro-1,2,3-benzodithiazol-1-iumNCI60_006218CHEMBL2010214DTXSID801279284742000-80-2
Database identifiers
- CAS
742000-80-2- PubChem CID
- 359775
- DTXSID
DTXSID801279284- ChEMBL
CHEMBL2010214
Properties
Computed structural properties
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 1
- Complexity
- 158
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Related reactions
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Compound notes
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