3,9-Diazabicyclo(3.3.1)nonane, 3,9-dimethyl-, dihydrochloride

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Basic information

CAS: 3431-15-0
Standard SMILES: CC1CC2CN(C)CC(C1)N2.Cl.Cl
InChIKey: HJWXXPPPFNHBQL-UHFFFAOYSA-N
Molecular formula: C9H20Cl2N2
Average molar mass: 227.17 g/mol
Monoisotopic mass: 226.100354

Names & identifiers

Preferred name: 3,9-Diazabicyclo(3.3.1)nonane, 3,9-dimethyl-, dihydrochloride
IUPAC: 3,7-dimethyl-3,9-diazabicyclo[3.3.1]nonane;dihydrochloride

Names & synonyms

3,9-Dimethyl-3,9-diazabicyclo(3.3.1)nonane dihydrochloride3431-15-03,9-DIAZABICYCLO(3.3.1)NONANE, 3,9-DIMETHYL-, DIHYDROCHLORIDERefChem:272776DTXSID609558603,7-Dimethyl-3,9-diazabicyclo[3.3.1]nonane--hydrogen chloride (1/2)

Database identifiers

CAS: 3431-15-0
PubChem CID: 18912
DTXSID: DTXSID60955860

Properties

Computed structural properties

Topological polar surface area: 15.3 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 13
Formal charge: 0
Complexity: 132

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Compound notes

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