Basic information
- CAS
2307773-50-6- Standard SMILES
C[C@H]1CNC[C@@H](C(=O)O)C1.Cl- InChIKey
BKDSFSVHZDQILN-IBTYICNHSA-N- Molecular formula
- C7H14ClNO2
- Average molar mass
- 179.64 g/mol
- Monoisotopic mass
- 179.0713064
Names & identifiers
- Preferred name
- (3S,5R)-5-Methylpiperidine-3-carboxylic acid hydrochloride
- IUPAC
- (3S,5R)-5-methylpiperidine-3-carboxylic acid;hydrochloride
Names & synonyms
rac-(3r,5s)-5-methylpiperidine-3-carboxylic acid hydrochloride(3S,5R)-5-Methylpiperidine-3-carboxylic acid hydrochloride
Database identifiers
- CAS
2307773-50-6- PubChem CID
- 164662425
- EC Number
- 196-797-9
Properties
Computed structural properties
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 136
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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