Basic information
- CAS
15521-07-0- Standard SMILES
CC(COC(=O)C1CC2CC[N+]1(C)CC2)[N+](C)(C)C.[I-].[I-]- InChIKey
SNTRNYFGXUVYFR-UHFFFAOYSA-L- Molecular formula
- C15H30I2N2O2
- Average molar mass
- 524.22 g/mol
- Monoisotopic mass
- 524.03967
Names & identifiers
- Preferred name
- Quinuclidinium, 2-carboxy-1-methyl-, iodide, ester with (2-hydroxy-1-methylethyl)trimethylammonium iodide
- IUPAC
- trimethyl-[1-(1-methyl-1-azoniabicyclo[2.2.2]octane-2-carbonyl)oxypropan-2-yl]azanium diiodide
Names & synonyms
Of-170315521-07-0Quinuclidinium, 2-carboxy-1-methyl-, iodide, ester with (2-hydroxy-1-methylethyl)trimethylammonium iodideRefChem:378952DTXSID20935163AKOS0302418841-Methyl-2-{[2-(trimethylazaniumyl)propoxy]carbonyl}-1-azabicyclo[2.2.2]octan-1-ium diiodide
Database identifiers
- CAS
15521-07-0- PubChem CID
- 85863
- DTXSID
DTXSID20935163
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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