Quinuclidinium, 2-carboxy-1-methyl-, iodide, ester with (2-hydroxyethyl)trimethylammonium iodide
Basic information
- CAS
15623-83-3- Standard SMILES
C[N+](C)(C)CCOC(=O)C1CC2CC[N+]1(C)CC2.[I-].[I-]- InChIKey
ATGTZMGMKSLCDM-UHFFFAOYSA-L- Molecular formula
- C14H28I2N2O2
- Average molar mass
- 510.19 g/mol
- Monoisotopic mass
- 510.02402
Names & identifiers
- Preferred name
- Quinuclidinium, 2-carboxy-1-methyl-, iodide, ester with (2-hydroxyethyl)trimethylammonium iodide
- IUPAC
- trimethyl-[2-(1-methyl-1-azoniabicyclo[2.2.2]octane-2-carbonyl)oxyethyl]azanium diiodide
Names & synonyms
Of-170415623-83-3Quinuclidinium, 2-carboxy-1-methyl-, iodide, ester with (2-hydroxyethyl)trimethylammonium iodideRefChem:378954DTXSID609354051-Methyl-2-{[2-(trimethylazaniumyl)ethoxy]carbonyl}-1-azabicyclo[2.2.2]octan-1-ium diiodide1-Methyl-2-{[2-(trimethylazaniumyl)ethoxy]carbonyl}-1-azabicyclo[2.2.2]octan-1-iumato(2-) diiodido(2-)
Database identifiers
- CAS
15623-83-3- PubChem CID
- 85884
- DTXSID
DTXSID60935405
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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