Basic information
- CAS
22041-32-3- Standard SMILES
CCOC(=O)CC[N+]1(C)CCCC1.[I-]- InChIKey
UNCCDDBTAJIMCH-UHFFFAOYSA-M- Molecular formula
- C10H20INO2
- Average molar mass
- 313.18 g/mol
- Monoisotopic mass
- 313.05388
Names & identifiers
- Preferred name
- 1-(3-Ethoxy-3-oxopropyl)-1-methylpyrrolidin-1-ium iodide
- IUPAC
- ethyl 3-(1-methylpyrrolidin-1-ium-1-yl)propanoate iodide
Names & synonyms
22041-32-3DTXSID809446501-(3-ETHOXY-3-OXOPROPYL)-1-METHYLPYRROLIDIN-1-IUM IODIDERefChem:1054167DTXCID2013729891-(2-Carboxyethyl)-1-methylpyrrolidinium iodide ethyl esterPyrrolidinium, 1-(2-carboxyethyl)-1-methyl-, iodide, ethyl ester
Database identifiers
- CAS
22041-32-3- PubChem CID
- 89174
- DTXSID
DTXSID80944650
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 174
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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