Basic information
- CAS
1075-56-5- Standard SMILES
ClC=C(Cl)C[n+]1ccccc1.[Cl-]- InChIKey
RFRQQNJDUQXAAS-UHFFFAOYSA-M- Molecular formula
- C8H8Cl3N
- Average molar mass
- 224.5 g/mol
- Monoisotopic mass
- 222.972232
Names & identifiers
- Preferred name
- 1-(2,3-Dichloroallyl)pyridinium chloride
- IUPAC
- 1-(2,3-dichloroprop-2-enyl)pyridin-1-ium chloride
Names & synonyms
1-(2,3-Dichloroallyl)pyridinium chloride1075-56-5SCHEMBL4269545DTXSID101366151DB-249772
Database identifiers
- CAS
1075-56-5- PubChem CID
- 70637
- DTXSID
DTXSID101366151- EC Number
- 214-055-5
Properties
Computed structural properties
- Topological polar surface area
- 3.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 139
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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