2,2,3,3,4,4,4-Heptafluoro-1-(4-phenyl-1-piperazinyl)-1-butanone
Basic information
- CAS
574714-45-7- Standard SMILES
O=C(N1CCN(c2ccccc2)CC1)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
UIPQZQRACZEVPW-UHFFFAOYSA-N- Molecular formula
- C14H13F7N2O
- Average molar mass
- 358.25 g/mol
- Monoisotopic mass
- 358.09161018
Names & identifiers
- Preferred name
- 2,2,3,3,4,4,4-Heptafluoro-1-(4-phenyl-1-piperazinyl)-1-butanone
- IUPAC
- 2,2,3,3,4,4,4-heptafluoro-1-(4-phenylpiperazin-1-yl)butan-1-one
Names & synonyms
DTXSID9013451052,2,3,3,4,4,4-Heptafluoro-1-(4-phenyl-1-piperazinyl)-1-butanoneAKOS003792034574714-45-7
Database identifiers
- CAS
574714-45-7- PubChem CID
- 4128718
- DTXSID
DTXSID901345105
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 453
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…