9-Azabicyclo(3.3.1)nonane, 3-alpha-(p-chlorodiphenylmethoxy)-9-methyl
Basic information
- CAS
6606-20-8- Standard SMILES
CN1C2CCCC1CC(OC(c1ccccc1)c1ccc(Cl)cc1)C2- InChIKey
GLQASCBBGDNRPG-UHFFFAOYSA-N- Molecular formula
- C22H26ClNO
- Average molar mass
- 355.9 g/mol
- Monoisotopic mass
- 355.1702921
Names & identifiers
- Preferred name
- 9-Azabicyclo(3.3.1)nonane, 3-alpha-(p-chlorodiphenylmethoxy)-9-methyl
- IUPAC
- 3-[(4-chlorophenyl)-phenylmethoxy]-9-methyl-9-azabicyclo[3.3.1]nonane
Names & synonyms
KSD 2118BRN 14960136606-20-8N-Methyl-norgranatanol-3-alpha-(4-chlorobenzhydryl)aether [German]3-alpha-(p-Chlorodiphenylmethoxy)-9-methyl-9-azabicyclo(3.3.1)nonane9-AZABICYCLO(3.3.1)NONANE, 3-alpha-(p-CHLORODIPHENYLMETHOXY)-9-METHYLN-Methyl-norgranatanol-3-alpha-(4-chlorobenzhydryl)aetherRefChem:312966DTXSID909845423-[(4-chlorophenyl)(phenyl)methoxy]-9-methyl-9-azabicyclo[3.3.1]nonane
Database identifiers
- CAS
6606-20-8- PubChem CID
- 23086
- DTXSID
DTXSID90984542
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 402
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Compound notes
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