Ammonium, dibutyl-1,2-dithiolan-4-ylmethyl-, iodide
Basic information
- CAS
31007-50-8- Standard SMILES
CCCC[N+](C)(CCCC)C1CSSC1.[I-]- InChIKey
DFGWBMQKBHIEIW-UHFFFAOYSA-M- Molecular formula
- C12H26INS2
- Average molar mass
- 375.4 g/mol
- Monoisotopic mass
- 375.05514
Names & identifiers
- Preferred name
- Ammonium, dibutyl-1,2-dithiolan-4-ylmethyl-, iodide
- IUPAC
- dibutyl-(dithiolan-4-yl)-methylazanium iodide
Names & synonyms
31007-50-8AMMONIUM, DIBUTYL-1,2-DITHIOLAN-4-YLMETHYL-, IODIDERefChem:1076863Dibutyl-1,2-dithiolan-4-ylmethylammonium iodideDTXSID30953131N,N-Dibutyl-N-methyl-1,2-dithiolan-4-aminium iodide
Database identifiers
- CAS
31007-50-8- PubChem CID
- 35710
- DTXSID
DTXSID30953131
Properties
Computed structural properties
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 159
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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