2,3-Dimethyl-7-phenylisoquinolin-2-ium iodide

HCID 32409

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Basic information

CAS: 24464-33-3
Standard SMILES: Cc1cc2ccc(-c3ccccc3)cc2c[n+]1C.[I-]
InChIKey: RQUKKEPNYVOXAV-UHFFFAOYSA-M
Molecular formula: C17H16IN
Average molar mass: 361.22 g/mol
Monoisotopic mass: 361.03275

Names & identifiers

Preferred name: 2,3-Dimethyl-7-phenylisoquinolin-2-ium iodide
IUPAC: 2,3-dimethyl-7-phenylisoquinolin-2-ium iodide

Names & synonyms

24464-33-32,3-dimethyl-7-phenylisoquinolin-2-ium iodideDTXSID30947358RefChem:1059468DTXCID0013756181,2-Dimethyl-7-phenylisoquinolinium iodideISOQUINOLINIUM, 1,2-DIMETHYL-7-PHENYL-, IODIDE

Database identifiers

CAS: 24464-33-3
PubChem CID: 32409
DTXSID: DTXSID30947358

Properties

Computed structural properties

Topological polar surface area: 3.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 19
Formal charge: 0
Complexity: 269

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