Basic information
- CAS
100538-93-0- Standard SMILES
CC(C)CC[NH+]1CC2CCC(CC2)C1.[Br-]- InChIKey
KVDMIPLJPJRZCO-UHFFFAOYSA-N- Molecular formula
- C13H26BrN
- Average molar mass
- 276.26 g/mol
- Monoisotopic mass
- 275.12486
Names & identifiers
- Preferred name
- 3-Azabicyclo(3.3.1)nonane, 3-isopentyl-, hydrobromide
- IUPAC
- 3-(3-methylbutyl)-3-azoniabicyclo[3.2.2]nonane bromide
Names & synonyms
N-Isopentil-3-isogranatanina bromidrato [Italian]100538-93-0N-Isopentil-3-isogranatanina bromidrato3-Isopentyl-3-azabicyclo(3.3.1)nonane hydrobromide3-AZABICYCLO(3.3.1)NONANE, 3-ISOPENTYL-, HYDROBROMIDERefChem:2767753-(3-methylbutyl)-3-azoniabicyclo[3.2.2]nonane;bromide
Database identifiers
- CAS
100538-93-0- PubChem CID
- 57941
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 154
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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