1,1'-Bis(1-methylethyl)-4,4'-bipyridinium
Basic information
- CAS
46903-02-0- Standard SMILES
CC(C)[n+]1ccc(-c2cc[n+](C(C)C)cc2)cc1- InChIKey
PEEXYZNONDIJMD-UHFFFAOYSA-N- Molecular formula
- C16H22N2+2
- Average molar mass
- 242.36 g/mol
- Monoisotopic mass
- 242.17829871
Names & identifiers
- Preferred name
- 1,1'-Bis(1-methylethyl)-4,4'-bipyridinium
- IUPAC
- 1-propan-2-yl-4-(1-propan-2-ylpyridin-1-ium-4-yl)pyridin-1-ium
Names & synonyms
46903-02-0SCHEMBL22953081DTXSID5010350811,1'-Bis(1-methylethyl)-4,4'-bipyridinium4,4'-Bipyridinium, 1,1'-bis(1-methylethyl)-
Database identifiers
- CAS
46903-02-0- PubChem CID
- 201551
- DTXSID
DTXSID501035081- Nikkaji
- J2.807.998B
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 7.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 2
- Complexity
- 207
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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