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Basic information
- CAS
20622-22-4- Standard SMILES
O=C(c1ccccc1)C(c1ccccc1)[NH+](Cc1ccccc1)c1ccccn1.[Cl-]- InChIKey
RVVJDWUFWWMPLD-UHFFFAOYSA-N- Molecular formula
- C26H23ClN2O
- Average molar mass
- 414.9 g/mol
- Monoisotopic mass
- 414.1498911
Names & identifiers
- Preferred name
- Acetophenone, 2-(benzyl(2-pyridyl)amino)-2-phenyl-, hydrochloride
- IUPAC
- benzyl-(2-oxo-1,2-diphenylethyl)-pyridin-2-ylazanium chloride
Names & synonyms
2-(Benzyl(2-pyridyl)amino)-2-phenylacetophenone, hydrochlorideACETOPHENONE, 2-(BENZYL(2-PYRIDYL)AMINO)-2-PHENYL-, HYDROCHLORIDE20622-22-4RefChem:316910
Database identifiers
- CAS
20622-22-4- PubChem CID
- 30203
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 34.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 489
Related reactions
0 records
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Compound notes
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