Basic information
- CAS
17239-49-5- Standard SMILES
CC[N+](C)(CC)CCOC(=O)C1CCCC(C)[N+]1(C)C- InChIKey
YMGPQLQONLLWJR-UHFFFAOYSA-N- Molecular formula
- C16H34N2O2+2
- Average molar mass
- 286.45 g/mol
- Monoisotopic mass
- 286.26202833
Names & identifiers
- Preferred name
- Dicolinium
- IUPAC
- diethyl-methyl-[2-(1,1,6-trimethylpiperidin-1-ium-2-carbonyl)oxyethyl]azanium
Names & synonyms
DicoliniumDicolinium ionDicolinium cation(+/-)-DicoliniumUNII-6E893SB73H6E893SB73H17239-49-5Piperidinium, 2-((2-(diethylmethylammonio)ethoxy)carbonyl)-1,1,6-trimethyl-orb2815431CHEMBL2110845T202276Q27264676
Database identifiers
- CAS
17239-49-5- PubChem CID
- 71498
- ChEMBL
CHEMBL2110845- UNII
- 6E893SB73H
- Nikkaji
- J2.406.111F
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 2
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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