Benzyl-dimethyl-(phenylsulfanylmethyl)azanium
Basic information
- CAS
7154-02-1- Standard SMILES
C[N+](C)(CSc1ccccc1)Cc1ccccc1- InChIKey
FTZRCQHVKQRFSF-UHFFFAOYSA-N- Molecular formula
- C16H20NS+
- Average molar mass
- 258.4 g/mol
- Monoisotopic mass
- 258.13164582
Names & identifiers
- Preferred name
- Benzyl-dimethyl-(phenylsulfanylmethyl)azanium
- IUPAC
- benzyl-dimethyl-(phenylsulfanylmethyl)azanium
Names & synonyms
7154-02-1benzyl-dimethyl-(phenylsulfanylmethyl)azaniumNCIOpen2_002294DTXSID60328838N,N-Dimethyl(phenyl)-N-[(phenylsulfanyl)methyl]methanaminium
Database identifiers
- CAS
7154-02-1- PubChem CID
- 414362
- DTXSID
DTXSID60328838
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 1
- Complexity
- 227
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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