Basic information
- Standard SMILES
CCOC1(N2CC3CC(=O)C(C3)C2)OCCO1- InChIKey
LQHRFAYDUIAKTA-UHFFFAOYSA-N- Molecular formula
- C12H19NO4
- Average molar mass
- 241.28 g/mol
- Monoisotopic mass
- 241.13140809
Names & identifiers
- Preferred name
- Ethyl 6-oxo-3-azabicyclo[3.2.1]octane-3-carboxylate ethylene ketal
- IUPAC
- 3-(2-ethoxy-1,3-dioxolan-2-yl)-3-azabicyclo[3.2.1]octan-6-one
Names & synonyms
LQHRFAYDUIAKTA-UHFFFAOYSA-NEthyl 6-oxo-3-azabicyclo[3.2.1]octane-3-carboxylate ethylene ketal
Database identifiers
- PubChem CID
- 86602199
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 314
Related reactions
5 records
Compound notes
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