Basic information
- CAS
52806-02-7- Standard SMILES
C[n+]1ccccc1-c1ccccc1.[I-]- InChIKey
STEAPXCCJBFSKG-UHFFFAOYSA-M- Molecular formula
- C12H12IN
- Average molar mass
- 297.13 g/mol
- Monoisotopic mass
- 297.00145
Names & identifiers
- Preferred name
- Picolinium, 2-phenyl-, iodide
- IUPAC
- 1-methyl-2-phenylpyridin-1-ium iodide
Names & synonyms
52806-02-7PICOLINIUM, 2-PHENYL-, IODIDERefChem:10955972-Phenylpicolinium iodide1-methyl-2-phenylpyridin-1-ium iodidePan-W-49Pyridinium, 1-methyl-2-phenyl-, iodideDTXSID80967268
Database identifiers
- CAS
52806-02-7- PubChem CID
- 40531
- DTXSID
DTXSID80967268
Properties
Computed structural properties
- Topological polar surface area
- 3.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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