Basic information
- CAS
101975-99-9- Standard SMILES
Br.Br.CC(CCc1ccccc1)N1CCN(C(C)CCc2ccccc2)CC1- InChIKey
DUJDCWYIPCMRPQ-UHFFFAOYSA-N- Molecular formula
- C24H36Br2N2
- Average molar mass
- 512.4 g/mol
- Monoisotopic mass
- 510.12452
Names & identifiers
- Preferred name
- Piperazine, 1,4-bis(1-methyl-3-phenylpropyl)-, dihydrobromide
- IUPAC
- 1,4-bis(4-phenylbutan-2-yl)piperazine;dihydrobromide
Names & synonyms
101975-99-9Piperazine, 1,4-bis(1-methyl-3-phenylpropyl)-, dihydrobromideRefChem:1095633F 2111,4-Bis(1-methyl-3-phenylpropyl)piperazine dihydrobromidePiperazine, 1,4-bis(1-phenyl-2-butyl)-, dihydrobromideDTXSID509069221,4-Bis(4-phenylbutan-2-yl)piperazine--hydrogen bromide (1/2)
Database identifiers
- CAS
101975-99-9- PubChem CID
- 3064091
- DTXSID
DTXSID50906922
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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