Basic information
- CAS
823197-53-1- Standard SMILES
FC(F)(F)COc1ccc(N2CCNCC2)cc1- InChIKey
HPSPMCQNULMOEN-UHFFFAOYSA-N- Molecular formula
- C12H15F3N2O
- Average molar mass
- 260.26 g/mol
- Monoisotopic mass
- 260.11364776
Names & identifiers
- Preferred name
- 1-[4-(2,2,2-Trifluoroethoxy)phenyl]piperazine
- IUPAC
- 1-[4-(2,2,2-trifluoroethoxy)phenyl]piperazine
Names & synonyms
1-[4-(2,2,2-trifluoroethoxy)phenyl]piperazine823197-53-11-(4-(2,2,2-Trifluoroethoxy)phenyl)piperazineSCHEMBL1470363SCHEMBL7181928DTXSID30656099AKOS005840738A1-43366
Database identifiers
- CAS
823197-53-1- PubChem CID
- 43510344
- DTXSID
DTXSID30656099
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 24.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 246
Related reactions
4 records
Compound notes
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