Basic information
- CAS
95946-00-2- Standard SMILES
C[NH+](C)CCC[NH+]1CCC2(CCC(C(C)(C)C)CC2)CC1.[Cl-].[Cl-]- InChIKey
VYVHBWNKDOBBEH-UHFFFAOYSA-N- Molecular formula
- C19H40Cl2N2
- Average molar mass
- 367.4 g/mol
- Monoisotopic mass
- 366.2568547
Names & identifiers
- Preferred name
- 3-Azaspiro(5.5)undecane, 9-tert-butyl-3-(3-(dimethylamino)propyl)-, dihydrochloride
- IUPAC
- 3-(9-tert-butyl-3-azoniaspiro[5.5]undecan-3-yl)propyl-dimethylazanium dichloride
Names & synonyms
3-Azaspiro(5.5)undecane, 9-tert-butyl-3-(3-(dimethylamino)propyl)-, dihydrochloride95946-00-2N-Dimethylaminopropyl-9-t-butyl-3-azaspiro(5.5)undecane dihydrochlorideRefChem:2767953-(3-tert-Butyl-9-azoniaspiro[5.5]undecan-9-yl)propyl-dimethylazaniumdichloride3-Azaspiro(5.5)undecane, 9-tert-butyl-3-(3-(dimethylamino)propyl)-, dihydrochloride, N-Dimethylaminopropyl-9-t-butyl-3-azaspiro(5.5)undecane dihydrochloride, AC1L1M34, LS-22737, 3-(3-tert-butyl-9-azoniaspiro[5.5]undecan-9-yl)propyl-dimethylazanium dichloride, 95946-00-2
Database identifiers
- CAS
95946-00-2- PubChem CID
- 56992
Properties
Computed structural properties
- Topological polar surface area
- 8.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 298
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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