Basic information
- CAS
68315-17-3- Standard SMILES
CCCCCCCCCCCCSC[n+]1ccccc1.[Cl-]- InChIKey
CFHPXSGNGMPEDD-UHFFFAOYSA-M- Molecular formula
- C18H32ClNS
- Average molar mass
- 330 g/mol
- Monoisotopic mass
- 329.1943989
Names & identifiers
- Preferred name
- 1-((Dodecylthio)methyl)pyridinium, chloride
- IUPAC
- 1-(dodecylsulfanylmethyl)pyridin-1-ium chloride
Names & synonyms
68315-17-31-((DODECYLTHIO)METHYL)PYRIDINIUM, CHLORIDEDTXSID909878511-[(Dodecylsulfanyl)methyl]pyridin-1-ium chloride
Database identifiers
- CAS
68315-17-3- PubChem CID
- 50141
- DTXSID
DTXSID90987851
Properties
Computed structural properties
- Topological polar surface area
- 29.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 13
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 190
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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