Basic information
- CAS
67238-96-4- Standard SMILES
CC1CCCCN1CCCOC(=O)CC1CCCCC1.Cl- InChIKey
RTOCXNBATKRZSC-UHFFFAOYSA-N- Molecular formula
- C17H32ClNO2
- Average molar mass
- 317.9 g/mol
- Monoisotopic mass
- 317.212157
Names & identifiers
- Preferred name
- Cyclohexaneacetic acid, 3-(2-methylpiperidino)propyl ester, hydrochloride
- IUPAC
- 3-(2-methylpiperidin-1-yl)propyl 2-cyclohexylacetate;hydrochloride
Names & synonyms
Cyclohexaneacetic acid, 3-(2-methylpiperidino)propyl ester, hydrochloride67238-96-4RefChem:1082499DTXSID609863913-(2-Methylpiperidin-1-yl)propyl cyclohexylacetate--hydrogen chloride (1/1)
Database identifiers
- CAS
67238-96-4- PubChem CID
- 3051007
- DTXSID
DTXSID60986391
Properties
Computed structural properties
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 287
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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