3,7-Diazabicyclo(3.3.1)nonane, 3-butyl-7-methyl-, hydrobromide
Basic information
- CAS
58324-88-2- Standard SMILES
CCCCN1CC2CC(C1)C[NH+](C)C2.[Br-]- InChIKey
JPGYANVAXRTDPS-UHFFFAOYSA-N- Molecular formula
- C12H25BrN2
- Average molar mass
- 277.24 g/mol
- Monoisotopic mass
- 276.12011
Names & identifiers
- Preferred name
- 3,7-Diazabicyclo(3.3.1)nonane, 3-butyl-7-methyl-, hydrobromide
- IUPAC
- 3-butyl-7-methyl-3-aza-7-azoniabicyclo[3.3.1]nonane bromide
Names & synonyms
3-Butyl-7-methylbispidine hydrobromide3-Butyl-7-methyl-3,7-diazabicyclo(3.3.1)nonane hydrobromide3,7-DIAZABICYCLO(3.3.1)NONANE, 3-BUTYL-7-METHYL-, HYDROBROMIDE58324-88-2RefChem:272528
Database identifiers
- CAS
58324-88-2- PubChem CID
- 42716
Properties
Computed structural properties
- Topological polar surface area
- 7.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 167
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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