Basic information
- CAS
159393-48-3- Standard SMILES
COC(=O)[NH+]1CCCCC1=N.[Cl-]- InChIKey
GPFSNPPQQXSJGF-UHFFFAOYSA-N- Molecular formula
- C7H13ClN2O2
- Average molar mass
- 192.64 g/mol
- Monoisotopic mass
- 192.0665554
Overview
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Names & identifiers
- Preferred name
- Methyl 2-iminopiperidin-1-ium-1-carboxylate chloride
- IUPAC
- methyl 2-iminopiperidin-1-ium-1-carboxylate chloride
Database identifiers
- CAS
159393-48-3- PubChem CID
- 11206331
Properties
Computed structural properties
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 179
Related reactions
0 records
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Compound notes
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