Basic information
- CAS
46231-82-7- Standard SMILES
C=Cc1ccc(C[N+](C)(C)C)cc1- InChIKey
WIKAJTNLVCYEQJ-UHFFFAOYSA-N- Molecular formula
- C12H18N+
- Average molar mass
- 176.28 g/mol
- Monoisotopic mass
- 176.14392458
Names & identifiers
- Preferred name
- Benzenemethanaminium, 4-ethenyl-N,N,N-trimethyl-
- IUPAC
- (4-ethenylphenyl)methyl-trimethylazanium
Names & synonyms
Benzenemethanaminium, 4-ethenyl-N,N,N-trimethyl-46231-82-7DTXSID90276757RefChem:324862DTXCID40227996SCHEMBL1119853(4-ethenylphenyl)-N,N,N-trimethylmethanaminium
Database identifiers
- CAS
46231-82-7- PubChem CID
- 198059
- DTXSID
DTXSID90276757- Nikkaji
- J680.575B
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 1
- Complexity
- 158
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…