3-Azabicyclo(3.2.2)nonane-3-propanol, alpha-(p-butylphenyl)-alpha-phenyl-, hydrochloride
Basic information
- CAS
73855-70-6- Standard SMILES
CCCCc1ccc(C(O)(CC[NH+]2CC3CCC(CC3)C2)c2ccccc2)cc1.[Cl-]- InChIKey
SRYSZBVMUKLKKU-UHFFFAOYSA-N- Molecular formula
- C27H38ClNO
- Average molar mass
- 428 g/mol
- Monoisotopic mass
- 427.2641925
Names & identifiers
- Preferred name
- 3-Azabicyclo(3.2.2)nonane-3-propanol, alpha-(p-butylphenyl)-alpha-phenyl-, hydrochloride
- IUPAC
- 3-(3-azoniabicyclo[3.2.2]nonan-3-yl)-1-(4-butylphenyl)-1-phenylpropan-1-ol chloride
Names & synonyms
3-Azabicyclo(3.2.2)nonane-3-propanol, alpha-(p-butylphenyl)-alpha-phenyl-, hydrochloride73855-70-6RefChem:1067347NSC 95491alpha-(p-Butylphenyl)-alpha-phenyl-3-azabicyclo(3.2.2)nonane-3-propanol hydrochloride3-Azabicyclo(3.2.2)nonane-3-propanol, alpha-(4-butylphenyl)-alpha-phenyl-, hydrochloride
Database identifiers
- CAS
73855-70-6- PubChem CID
- 52657
Properties
Computed structural properties
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 457
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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