Basic information
- CAS
67049-52-9- Standard SMILES
CC1CCC[NH+](CCCOC(=O)c2ccccc2O)C1C.[Cl-]- InChIKey
DVBRKGKPLZXARL-UHFFFAOYSA-N- Molecular formula
- C17H26ClNO3
- Average molar mass
- 327.8 g/mol
- Monoisotopic mass
- 327.1601214
Names & identifiers
- Preferred name
- 3-(2,3-Dimethylpiperidin-1-yl)propyl 2-hydroxybenzoate--hydrogen chloride (1/1)
- IUPAC
- 3-(2,3-dimethylpiperidin-1-ium-1-yl)propyl 2-hydroxybenzoate chloride
Names & synonyms
67049-52-9DTXSID909859983-(2,3-Dimethylpiperidin-1-yl)propyl 2-hydroxybenzoate--hydrogen chloride (1/1)RefChem:1066424DTXCID601413187o-Hydroxybenzoic acid 3-(2,3-dimethylpiperidino)propyl ester hydrochlorideBENZOIC ACID, o-HYDROXY-, 3-(2,3-DIMETHYLPIPERIDINO)PROPYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
67049-52-9- PubChem CID
- 49068
Properties
Computed structural properties
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 334
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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