Acetic acid, p-hydroxyphenyl-, 3-(2-methylpiperidino)propyl ester, hydrochloride
Basic information
- CAS
66902-55-4- Standard SMILES
CC1CCCC[NH+]1CCCOC(=O)Cc1ccc(O)cc1.[Cl-]- InChIKey
BXIRNPJAISRFCG-UHFFFAOYSA-N- Molecular formula
- C17H26ClNO3
- Average molar mass
- 327.8 g/mol
- Monoisotopic mass
- 327.1601214
Names & identifiers
- Preferred name
- Acetic acid, p-hydroxyphenyl-, 3-(2-methylpiperidino)propyl ester, hydrochloride
- IUPAC
- 3-(2-methylpiperidin-1-ium-1-yl)propyl 2-(4-hydroxyphenyl)acetate chloride
Names & synonyms
ACETIC ACID, p-HYDROXYPHENYL-, 3-(2-METHYLPIPERIDINO)PROPYL ESTER, HYDROCHLORIDE66902-55-4RefChem:1075830p-Hydroxyphenylacetic acid 3-(2-methylpiperidino)propyl ester hydrochloride
Database identifiers
- CAS
66902-55-4- PubChem CID
- 48268
Properties
Computed structural properties
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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