9-Azabicyclo(3.3.1)nonane, 7,9-dimethyl-3-alpha-(diphenylmethoxy)-

HCID 23072

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Basic information

CAS: 6605-95-4
Standard SMILES: CC1CC2CC(OC(c3ccccc3)c3ccccc3)CC(C1)N2C
InChIKey: HVAGLFDOZPAKNY-UHFFFAOYSA-N
Molecular formula: C23H29NO
Average molar mass: 335.5 g/mol
Monoisotopic mass: 335.22491455

Names & identifiers

Preferred name: 9-Azabicyclo(3.3.1)nonane, 7,9-dimethyl-3-alpha-(diphenylmethoxy)-
IUPAC: 3-benzhydryloxy-7,9-dimethyl-9-azabicyclo[3.3.1]nonane

Names & synonyms

KSD 22256605-95-4N,7-Dimethyl-norgranatanol-3-alpha-benzhydrylaether [German]7,9-Dimethyl-3-alpha-(diphenylmethoxy)-9-azabicyclo(3.3.1)nonaneN,7-Dimethyl-norgranatanol-3-alpha-benzhydrylaether9-AZABICYCLO(3.3.1)NONANE, 7,9-DIMETHYL-3-alpha-(DIPHENYLMETHOXY)-RefChem:312969DTXSID809845163-(DIPHENYLMETHOXY)-7,9-DIMETHYL-9-AZABICYCLO[3.3.1]NONANE

Database identifiers

CAS: 6605-95-4
PubChem CID: 23072
DTXSID: DTXSID80984516

Properties

Computed structural properties

XLogP: 5.3
Topological polar surface area: 12.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 25
Formal charge: 0
Complexity: 378

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