Basic information
- CAS
67032-06-8- Standard SMILES
CC1CCCC[NH+]1CCCOC(=O)c1ccc(O)cc1.[Cl-]- InChIKey
CXAKNCHKTSSYDU-UHFFFAOYSA-N- Molecular formula
- C16H24ClNO3
- Average molar mass
- 313.82 g/mol
- Monoisotopic mass
- 313.1444713
Names & identifiers
- Preferred name
- 3-(2-Methylpiperidin-1-yl)propyl 4-hydroxybenzoate--hydrogen chloride (1/1)
- IUPAC
- 3-(2-methylpiperidin-1-ium-1-yl)propyl 4-hydroxybenzoate chloride
Names & synonyms
67032-06-8DTXSID709859513-(2-Methylpiperidin-1-yl)propyl 4-hydroxybenzoate--hydrogen chloride (1/1)RefChem:1066589DTXCID301413140p-Hydroxybenzoic acid 3-(2-methylpiperidino)propyl ester hydrochlorideBENZOIC ACID, p-HYDROXY-, 3-(2-METHYLPIPERIDINO)PROPYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
67032-06-8- PubChem CID
- 48977
Properties
Computed structural properties
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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