Basic information
- CAS
63977-30-0- Standard SMILES
CCOc1ccc(OCC[N+](CC)(CC)CC)cc1.[I-]- InChIKey
AXHFOPRUZWKQJM-UHFFFAOYSA-M- Molecular formula
- C16H28INO2
- Average molar mass
- 393.3 g/mol
- Monoisotopic mass
- 393.11648
Names & identifiers
- Preferred name
- 2-(4-Ethoxyphenoxy)-N,N,N-triethylethan-1-aminium iodide
- IUPAC
- 2-(4-ethoxyphenoxy)ethyl-triethylazanium iodide
Names & synonyms
63977-30-0DTXSID909813992-(4-Ethoxyphenoxy)-N,N,N-triethylethan-1-aminium iodideRefChem:1061235DTXCID001408671AMMONIUM, (2-(p-ETHOXYPHENOXY)ETHYL)TRIETHYL-, IODIDEp-Ethoxy-beta-diethylaminoethoxybenzene ethiodide
Database identifiers
- CAS
63977-30-0- PubChem CID
- 45767
- DTXSID
DTXSID90981399
Properties
Computed structural properties
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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