2,4-Bis(2-(4-(dimethylamino)phenyl)vinyl)-1-ethylpyridinium iodide
Basic information
- CAS
84195-77-7- Standard SMILES
CC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1/C=C/c1ccc(N(C)C)cc1.[I-]- InChIKey
XPRYLWBGHVPGNC-UHFFFAOYSA-M- Molecular formula
- C27H32IN3
- Average molar mass
- 525.5 g/mol
- Monoisotopic mass
- 525.1641
Names & identifiers
- Preferred name
- 2,4-Bis(2-(4-(dimethylamino)phenyl)vinyl)-1-ethylpyridinium iodide
- IUPAC
- 4-[(E)-2-[2-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]-1-ethylpyridin-1-ium-4-yl]ethenyl]-N,N-dimethylaniline iodide
Names & synonyms
84195-77-7EINECS 282-384-12,4-Bis(2-(4-(dimethylamino)phenyl)vinyl)-1-ethylpyridinium iodideSCHEMBL8745564NS00058452
Database identifiers
- CAS
84195-77-7- PubChem CID
- 9893071
- EC Number
- 282-384-1
Properties
Computed structural properties
- Topological polar surface area
- 10.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 536
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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