Pyridinium, 4-(2-inden-1-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromide
Basic information
- CAS
21199-29-1- Standard SMILES
C[N+](C)(C)CCC[n+]1ccc(CCC2C=Cc3ccccc32)cc1.[Br-].[Br-]- InChIKey
GZJIADQNSYALBN-UHFFFAOYSA-L- Molecular formula
- C22H30Br2N2
- Average molar mass
- 482.3 g/mol
- Monoisotopic mass
- 480.07757
Names & identifiers
- Preferred name
- Pyridinium, 4-(2-inden-1-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromide
- IUPAC
- 3-[4-[2-(1H-inden-1-yl)ethyl]pyridin-1-ium-1-yl]propyl-trimethylazanium dibromide
Names & synonyms
21199-29-14-(2-Inden-1-ylethyl)-1-(3-(trimethylammonio)propyl)pyridinium dibromidePyridinium, 4-(2-inden-1-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromideRefChem:377230DTXSID109435354-[2-(1H-Inden-1-yl)ethyl]-1-[3-(trimethylazaniumyl)propyl]pyridin-1-ium dibromide
Database identifiers
- CAS
21199-29-1- PubChem CID
- 210247
- DTXSID
DTXSID10943535
Properties
Computed structural properties
- Topological polar surface area
- 3.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 401
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Compound notes
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