Basic information
- CAS
784083-82-5- Standard SMILES
CCOC(=O)N1CCN2CCC1C2- InChIKey
STABTCVRLBWOIJ-UHFFFAOYSA-N- Molecular formula
- C9H16N2O2
- Average molar mass
- 184.24 g/mol
- Monoisotopic mass
- 184.12117776
Names & identifiers
- Preferred name
- Ethyl 1,4-diazabicyclo[3.2.1]octane-4-carboxylate
- IUPAC
- ethyl 1,4-diazabicyclo[3.2.1]octane-4-carboxylate
- English name
- 1,4-Diazabicyclo[3.2.1]octane-4-carboxylic acid, ethyl ester
- Molecular formula
- C9H16N2O2
- Molecular weight
- 0
Names & synonyms
784083-82-5ethyl 1,4-diazabicyclo[3.2.1]octane-4-carboxylateSCHEMBL11878413DTXSID004949851,4-Diazabicyclo[3.2.1]octane-4-carboxylic acid, ethyl ester
Database identifiers
- CAS
784083-82-5- PubChem CID
- 12374079
- DTXSID
DTXSID00494985
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 208
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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