2-[(Dimethylamino)methyl]-1-phenylbutan-1-one--hydrogen chloride (1/1)
Basic information
- CAS
67362-34-9- Standard SMILES
CCC(CN(C)C)C(=O)c1ccccc1.Cl- InChIKey
WRZZYXWJLJCBHE-UHFFFAOYSA-N- Molecular formula
- C13H20ClNO
- Average molar mass
- 241.76 g/mol
- Monoisotopic mass
- 241.123342
Names & identifiers
- Preferred name
- 2-[(Dimethylamino)methyl]-1-phenylbutan-1-one--hydrogen chloride (1/1)
- IUPAC
- 2-[(dimethylamino)methyl]-1-phenylbutan-1-one;hydrochloride
Names & synonyms
67362-34-9CHEMBL3337637DTXSID30332528NSC90266NSC-902662-[(Dimethylamino)methyl]-1-phenylbutan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
67362-34-9- PubChem CID
- 458523
- DTXSID
DTXSID30332528- ChEMBL
CHEMBL3337637
Properties
Computed structural properties
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 195
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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