Phenol, 2-(6,7-dimethyl-6-azabicyclo(3.2.1)oct-1-yl)-, hydrobromide, endo-(+-)-
Basic information
- CAS
61126-99-6- Standard SMILES
Br.CC1N(C)C2CCCC1(c1ccccc1O)C2- InChIKey
CSZPKGZYNIVZEB-UHFFFAOYSA-N- Molecular formula
- C15H22BrNO
- Average molar mass
- 312.24 g/mol
- Monoisotopic mass
- 311.08848
Names & identifiers
- Preferred name
- Phenol, 2-(6,7-dimethyl-6-azabicyclo(3.2.1)oct-1-yl)-, hydrobromide, endo-(+-)-
- IUPAC
- 2-(6,7-dimethyl-6-azabicyclo[3.2.1]octan-1-yl)phenol;hydrobromide
Names & synonyms
endo-(+-)-2-(6,7-Dimethyl-6-azabicyclo(3.2.1)oct-1-yl)phenol hydrobromide61126-99-6Phenol, 2-(6,7-dimethyl-6-azabicyclo(3.2.1)oct-1-yl)-, hydrobromide, endo-(+-)-RefChem:368994CHEMBL3251432DTXSID709766422-(6,7-Dimethyl-6-azabicyclo[3.2.1]octan-1-yl)phenol--hydrogen bromide (1/1)
Database identifiers
- CAS
61126-99-6- PubChem CID
- 3045781
- DTXSID
DTXSID70976642- ChEMBL
CHEMBL3251432
Properties
Computed structural properties
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 293
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Compound notes
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