Basic information
- CAS
62590-92-5- Standard SMILES
CC(=O)CCN1CCC(O)(c2ccccc2)CC1.Cl- InChIKey
UPMDYIZACLETKW-UHFFFAOYSA-N- Molecular formula
- C15H22ClNO2
- Average molar mass
- 283.79 g/mol
- Monoisotopic mass
- 283.1339066
Names & identifiers
- Preferred name
- 4-(4-Hydroxy-4-phenylpiperidino)-2-butanone hydrochloride
- IUPAC
- 4-(4-hydroxy-4-phenylpiperidin-1-yl)butan-2-one;hydrochloride
Names & synonyms
62590-92-5SCHEMBL115348194-(4-hydroxy-4-phenylpiperidino)-2-butanone hydrochlorideDTXSID40612580UPMDYIZACLETKW-UHFFFAOYSA-N4-(4-hydroxy-4-phenypiperidino)-2-butanone hydrochloride4-(4-Hydroxy-4-phenylpiperidin-1-yl)butan-2-one--hydrogen chloride (1/1)
Database identifiers
- CAS
62590-92-5- PubChem CID
- 21332006
- DTXSID
DTXSID40612580
Properties
Computed structural properties
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 276
Related reactions
4 records
Compound notes
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