1-[(Dodecylsulfanyl)methyl]quinolin-1-ium chloride
Basic information
- CAS
70700-72-0- Standard SMILES
CCCCCCCCCCCCSC[n+]1cccc2ccccc21.[Cl-]- InChIKey
KGZJWTKIBVFBQO-UHFFFAOYSA-M- Molecular formula
- C22H34ClNS
- Average molar mass
- 380 g/mol
- Monoisotopic mass
- 379.210049
Names & identifiers
- Preferred name
- 1-[(Dodecylsulfanyl)methyl]quinolin-1-ium chloride
- IUPAC
- 1-(dodecylsulfanylmethyl)quinolin-1-ium chloride
Names & synonyms
70700-72-01-[(DODECYLSULFANYL)METHYL]QUINOLIN-1-IUM CHLORIDEDTXSID90537092
Database identifiers
- CAS
70700-72-0- PubChem CID
- 13330780
- DTXSID
DTXSID90537092
Properties
Computed structural properties
- Topological polar surface area
- 29.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 13
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 294
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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