Molecule ID: 14989482

IUPAC Name: 2-hydroxyethyl-dimethyl-(111C)methylazanium;chloride

Description: The molecule is a quaternary ammonium salt that is the chloride salt of (11)C-choline. An intravenous radioactive diagnostic agent used as a tracer during positron emission tomography scans to help detect sites of recurrent prostate cancer. It has a role as a radioactive tracer, a radioactive imaging agent and a diagnostic agent. It is a chloride salt, a quaternary ammonium salt and an (11)C-modified compound. It contains an (11)C-choline.

SMILES: C[N+](C)([11CH3])CCO.[Cl-]

SELFIES: [C][N+1][Branch1][C][C][Branch1][C][11CH3][C][C][O].[Cl-1]

InChI: InChI=1S/C5H14NO.ClH/c1-6(2,3)4-5-7;/h7H,4-5H2,1-3H3;1H/q+1;/p-1/i1-1;

Molecular Properties:
- Polar Surface Area: 20.2 Ų
- LogP: nan