(S)-1-(6-cyclohexyl-hexyl)-3-(1-methyl-pyrrolidin-2-yl)-pyridinium bromide hydrobromide salt
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Basic information
- Standard SMILES
Br.CN1CCC[C@H]1c1ccc[n+](CCCCCCC2CCCCC2)c1.[Br-]- InChIKey
HAJKYURYXLKTGA-IKXQUJFKSA-M- Molecular formula
- C22H38Br2N2
- Average molar mass
- 490.4 g/mol
Names & identifiers
- Preferred name
- (S)-1-(6-cyclohexyl-hexyl)-3-(1-methyl-pyrrolidin-2-yl)-pyridinium bromide hydrobromide salt
- IUPAC
- 1-(6-cyclohexylhexyl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridin-1-ium;bromide;hydrobromide
Names & synonyms
SCHEMBL5883777HAJKYURYXLKTGA-IKXQUJFKSA-M(S)-1-(6-cyclohexyl-hexyl)-3-(1-methyl-pyrrolidin-2-yl)-pyridinium bromide hydrobromide salt
Database identifiers
- PubChem CID
- 69596284
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 7.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 337
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Related reactions
1 records
Compound notes
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