Basic information
- Standard SMILES
C[n+]1sc(Cl)c(Cl)c1Cl- InChIKey
YLQOQHBUIVWPCL-UHFFFAOYSA-N- Molecular formula
- C4H3Cl3NS+
- Average molar mass
- 203.5 g/mol
- Monoisotopic mass
- 201.905178
Names & identifiers
- Preferred name
- 3,4,5-Trichloro-2-methyl-1,2-thiazol-2-ium
- IUPAC
- 3,4,5-trichloro-2-methyl-1,2-thiazol-2-ium
Names & synonyms
SCHEMBL10519707SCHEMBL10519713
Database identifiers
- PubChem CID
- 12889014
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 32.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 1
- Complexity
- 112
Related reactions
3 records
Compound notes
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