1-Piperidinepropanoic acid, 2-(2-ethoxy-2-oxoethyl)-, ethyl ester
Basic information
- CAS
99392-94-6- Standard SMILES
CCOC(=O)CCN1CCCCC1CC(=O)OCC- InChIKey
CBQDHKNYCRNMLW-UHFFFAOYSA-N- Molecular formula
- C14H25NO4
- Average molar mass
- 271.35 g/mol
- Monoisotopic mass
- 271.17835828
Names & identifiers
- Preferred name
- 1-Piperidinepropanoic acid, 2-(2-ethoxy-2-oxoethyl)-, ethyl ester
- IUPAC
- ethyl 3-[2-(2-ethoxy-2-oxoethyl)piperidin-1-yl]propanoate
Names & synonyms
99392-94-61-Piperidinepropanoic acid, 2-(2-ethoxy-2-oxoethyl)-, ethyl esterDTXSID20455159RefChem:234418DTXCID80405978SCHEMBL863902ETHYL 3-[2-(2-ETHOXY-2-OXOETHYL)PIPERIDIN-1-YL]PROPANOATE
Database identifiers
- CAS
99392-94-6- PubChem CID
- 11097645
- DTXSID
DTXSID20455159
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 293
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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