Basic information
- CAS
62936-28-1- Standard SMILES
C1C2CC3CC1CC(N1CCN(C45CC6CC(CC(C6)C4)C5)CC1)(C2)C3.Cl.Cl- InChIKey
RPAQSIHNHCGLHQ-UHFFFAOYSA-N- Molecular formula
- C24H40Cl2N2
- Average molar mass
- 427.5 g/mol
- Monoisotopic mass
- 426.2568547
Names & identifiers
- Preferred name
- Adamantane, 1,1'-(1,4-piperazinylene)bis-, dihydrochloride
- IUPAC
- 1,4-bis(1-adamantyl)piperazine;dihydrochloride
Names & synonyms
1,4-Bis(1-adamantyl)piperazine dihydrochloride62936-28-1Piperazine, 1,4-bis(1-adamantyl)-, dihydrochlorideADAMANTANE, 1,1'-(1,4-PIPERAZINYLENE)BIS-, DIHYDROCHLORIDEDTXSID00212141RefChem:317207DTXCID001346321,4-Di(adamantan-1-yl)piperazine--hydrogen chloride (1/2)
Database identifiers
- CAS
62936-28-1- PubChem CID
- 44217
- DTXSID
DTXSID00212141
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 452
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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