Basic information
- CAS
16183-86-1- Standard SMILES
Cc1ccc[n+](Cc2ccccc2)c1- InChIKey
KPLXPAJPJHQENL-UHFFFAOYSA-N- Molecular formula
- C13H14N+
- Average molar mass
- 184.26 g/mol
- Monoisotopic mass
- 184.11262445
Names & identifiers
- Preferred name
- N-Benzyl-3-methylpyridinium
- IUPAC
- 1-benzyl-3-methylpyridin-1-ium
Names & synonyms
1-Benzyl-3-picoliniumVZ95HHD9UMN-Benzyl-3-methylpyridiniumTimTec1_000102SCHEMBL5286396SCHEMBL30192808NCGC00175465-01Pyridinium, 3-methyl-1-(phenylmethyl)-16183-86-1
Database identifiers
- CAS
16183-86-1- PubChem CID
- 85334
- UNII
- VZ95HHD9UM
- Nikkaji
- J415.427D
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 3.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 1
- Complexity
- 161
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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