Basic information
- CAS
22041-34-5- Standard SMILES
CCOC(=O)CC[N+](C)(CC)CC.[I-]- InChIKey
AFPPJILHCMONGR-UHFFFAOYSA-M- Molecular formula
- C10H22INO2
- Average molar mass
- 315.19 g/mol
- Monoisotopic mass
- 315.06953
Names & identifiers
- Preferred name
- Ammonium, (2-carboxyethyl)diethylmethyl-, iodide, ethyl ester
- IUPAC
- (3-ethoxy-3-oxopropyl)-diethyl-methylazanium iodide
Names & synonyms
22041-34-5AMMONIUM, (2-CARBOXYETHYL)DIETHYLMETHYL-, IODIDE, ETHYL ESTERRefChem:1076718(2-Carboxyethyl)diethylmethylammonium iodide ethyl esterDTXSID009446523-ethoxy-N,N-diethyl-N-methyl-3-oxopropan-1-aminium iodide
Database identifiers
- CAS
22041-34-5- PubChem CID
- 30909
- DTXSID
DTXSID00944652
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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