Basic information
- CAS
157604-56-3- Standard SMILES
CCOC(=O)C1CCCN(CCBr)C1- InChIKey
HEMCHEJBFYNKQG-UHFFFAOYSA-N- Molecular formula
- C10H18BrNO2
- Average molar mass
- 264.16 g/mol
- Monoisotopic mass
- 263.05209092
Names & identifiers
- Preferred name
- Ethyl 1-(2-bromoethyl)-3-piperidinecarboxylate
- IUPAC
- ethyl 1-(2-bromoethyl)piperidine-3-carboxylate
Names & synonyms
157604-56-3Ethyl 1-(2-bromoethyl)-3-piperidinecarboxylateEthyl 1-(2-bromoethyl)piperidine-3-carboxylateSCHEMBL8871715DTXSID601245552AKOS010539422
Database identifiers
- CAS
157604-56-3- PubChem CID
- 10244523
- DTXSID
DTXSID601245552
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 187
Related reactions
8 records
Compound notes
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