Basic information
- CAS
6803-62-9- Standard SMILES
CCCCCCCCCCCC[n+]1c(C)cc(N)c2ccccc21- InChIKey
MJWHEEXHUDCWDA-UHFFFAOYSA-O- Molecular formula
- C22H35N2+
- Average molar mass
- 327.5 g/mol
- Monoisotopic mass
- 327.28002413
Names & identifiers
- Preferred name
- Laurolinium
- IUPAC
- 1-dodecyl-2-methylquinolin-1-ium-4-amine
Names & synonyms
LauroliniumLaurolinium ionLaurolinium cation4-amino-1-dodecyl-2-methylquinolinium1-Dodecyl-4-aminoquinaldinium4-Amino-1-dodecylquinaldiniumLaurolinium [WHO-DD]UNII-GK6KGT1235GK6KGT1235RefChem:1525166803-62-91-dodecyl-2-methylquinolin-1-ium-4-amine
Show more names
Quinolinium, 4-amino-1-dodecyl-2-methyl-4-amino-1-dodecyl-2-methylquinolin-1-iumorb1702085CHEMBL2110860SCHEMBL29388527DTXSID10861826AKOS040747016T25640
Database identifiers
- CAS
6803-62-9- PubChem CID
- 67355
- DTXSID
DTXSID10861826- ChEMBL
CHEMBL2110860- UNII
- GK6KGT1235
- Nikkaji
- J2.923.818I
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 29.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 11
- Heavy atoms
- 24
- Formal charge
- 1
- Complexity
- 317
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…