Basic information
- CAS
831197-09-2- Standard SMILES
CC(=O)OCC(=O)N1CCC[C@@H]1C- InChIKey
KKNDYNIKAFMZQF-ZETCQYMHSA-N- Molecular formula
- C9H15NO3
- Average molar mass
- 185.22 g/mol
- Monoisotopic mass
- 185.10519334
Names & identifiers
- Preferred name
- 2-[(2S)-2-Methylpyrrolidin-1-yl]-2-oxoethyl acetate
- IUPAC
- [2-[(2S)-2-methylpyrrolidin-1-yl]-2-oxoethyl] acetate
Names & synonyms
831197-09-22-[(2S)-2-Methylpyrrolidin-1-yl]-2-oxoethyl acetateDTXSID70835725
Database identifiers
- CAS
831197-09-2- PubChem CID
- 71416331
- DTXSID
DTXSID70835725
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 215
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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