3-Azabicyclo(3.2.2)nonane, 3-(3,3-diphenylpropyl)-, hydrochloride
Basic information
- CAS
3998-77-4- Standard SMILES
[Cl-].c1ccc(C(CC[NH+]2CC3CCC(CC3)C2)c2ccccc2)cc1- InChIKey
ORHCCLAQDXJOAA-UHFFFAOYSA-N- Molecular formula
- C23H30ClN
- Average molar mass
- 355.9 g/mol
- Monoisotopic mass
- 355.2066777
Names & identifiers
- Preferred name
- 3-Azabicyclo(3.2.2)nonane, 3-(3,3-diphenylpropyl)-, hydrochloride
- IUPAC
- 3-(3,3-diphenylpropyl)-3-azoniabicyclo[3.2.2]nonane chloride
Names & synonyms
3-AZABICYCLO(3.2.2)NONANE, 3-(3,3-DIPHENYLPROPYL)-, HYDROCHLORIDE3998-77-4RefChem:10673453-(3,3-Diphenylpropyl)-3-azabicyclo(3.2.2)nonane hydrochlorideNSC95501NSC 955013-(3,3-Diphenylpropyl)-3-azabicyclo(3.2.2)nonanehydrochloride
Database identifiers
- CAS
3998-77-4- PubChem CID
- 19899
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 326
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Compound notes
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