Basic information
- CAS
63951-19-9- Standard SMILES
C[N+](C)(C)Cc1ccc([N+](C)(C)C)cc1.[I-].[I-]- InChIKey
XKJPMAOXOIOVIC-UHFFFAOYSA-L- Molecular formula
- C13H24I2N2
- Average molar mass
- 462.15 g/mol
- Monoisotopic mass
- 462.00289
Names & identifiers
- Preferred name
- Ammonium, (p-trimethylammonio)benzyltrimethyl-, diiodide
- IUPAC
- trimethyl-[4-[(trimethylazaniumyl)methyl]phenyl]azanium diiodide
Names & synonyms
AMMONIUM, (p-TRIMETHYLAMMONIO)BENZYLTRIMETHYL-, DIIODIDE63951-19-9M & B 1899RefChem:319106trimethyl-[4-[(trimethylazaniumyl)methyl]phenyl]azanium;diiodideorb1986543DTXSID80981308AKOS040750478T30018N,N,N-Trimethyl-4-[(trimethylazaniumyl)methyl]anilinium diiodide
Database identifiers
- CAS
63951-19-9- PubChem CID
- 45648
- DTXSID
DTXSID80981308
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 190
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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