2-Phenyl-2-(1-pyrrolidinyl)-acetophenone hydrochloride
Basic information
- CAS
27590-61-0- Standard SMILES
O=C(c1ccccc1)C(c1ccccc1)[NH+]1CCCC1.[Cl-]- InChIKey
DZBGHEJUNJIOIJ-UHFFFAOYSA-N- Molecular formula
- C18H20ClNO
- Average molar mass
- 301.8 g/mol
- Monoisotopic mass
- 301.123342
Overview
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Names & identifiers
- Preferred name
- 2-Phenyl-2-(1-pyrrolidinyl)-acetophenone hydrochloride
- IUPAC
- 1,2-diphenyl-2-pyrrolidin-1-ium-1-ylethanone chloride
Names & synonyms
2-Phenyl-2-(1-pyrrolidinyl)-acetophenone hydrochloride27590-61-01,2-diphenyl-2-pyrrolidin-1-ium-1-ylethanone;chlorideDXD9KW7HFFUNII-DXD9KW7HFF(alpha-N-Pyrrolidino-benzyl)phenyl-cetone chlorhydrate [French]alpha-D2Pv hydrochlorideACETOPHENONE, 2-PHENYL-2-(1-PYRROLIDINYL)-, HYDROCHLORIDE(alpha-N-Pyrrolidino-benzyl)phenyl-cetone chlorhydrate
Database identifiers
- CAS
27590-61-0- PubChem CID
- 33956
Properties
Computed structural properties
- Topological polar surface area
- 21.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 309
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Compound notes
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