Basic information
- CAS
67032-05-7- Standard SMILES
CC1CCCC[NH+]1CCCOC(=O)c1ccccc1O.[Cl-]- InChIKey
JWWXCTWMACRUBN-UHFFFAOYSA-N- Molecular formula
- C16H24ClNO3
- Average molar mass
- 313.82 g/mol
- Monoisotopic mass
- 313.1444713
Overview
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Names & identifiers
- Preferred name
- m-Hydroxybenzoic acid 3-(2-methylpiperidino)propyl ester hydrochloride
- IUPAC
- 3-(2-methylpiperidin-1-ium-1-yl)propyl 2-hydroxybenzoate chloride
Names & synonyms
m-Hydroxybenzoic acid 3-(2-methylpiperidino)propyl ester hydrochloride
Database identifiers
- CAS
67032-05-7- PubChem CID
- 48976
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
- 308
Related reactions
0 records
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Compound notes
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