Basic information
- CAS
46154-58-9- Standard SMILES
CC[n+]1ccc(C)c2ccccc21- InChIKey
LCNWZISUNVZUOV-UHFFFAOYSA-N- Molecular formula
- C12H14N+
- Average molar mass
- 172.25 g/mol
- Monoisotopic mass
- 172.11262445
Names & identifiers
- Preferred name
- 1-Ethyl-4-methylquinolin-1-ium
- IUPAC
- 1-ethyl-4-methylquinolin-1-ium
Names & synonyms
1-ethyl-4-methylquinolin-1-ium1-ethyl-4-methylquinolinium46154-58-9UT2DLU7SVBChemDiv3_000327SCHEMBL1476988CHEMBL4081771Quinolinium, 1-ethyl-4-methyl-HMS1473O19STK874202AKOS001483262IDI1_019645
Show more names
NCGC00176025-01EU-00667591-ethyl-4-methylquinolin-1-ium--iodide (1/1)
Database identifiers
- CAS
46154-58-9- PubChem CID
- 69063
- ChEMBL
CHEMBL4081771- UNII
- UT2DLU7SVB
- Nikkaji
- J292.424B
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 3.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 1
- Complexity
- 167
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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