1-{1-[3-(Trifluoromethyl)phenyl]propyl}piperazine
Basic information
- CAS
519139-55-0- Standard SMILES
CCC(c1cccc(C(F)(F)F)c1)N1CCNCC1- InChIKey
ZMOWUUQPQSMIRW-UHFFFAOYSA-N- Molecular formula
- C14H19F3N2
- Average molar mass
- 272.31 g/mol
- Monoisotopic mass
- 272.1500331
Names & identifiers
- Preferred name
- 1-{1-[3-(Trifluoromethyl)phenyl]propyl}piperazine
- IUPAC
- 1-[1-[3-(trifluoromethyl)phenyl]propyl]piperazine
Names & synonyms
Piperazine, 1-[1-[3-(trifluoromethyl)phenyl]propyl]-DTXSID601219999519139-55-01-{1-[3-(Trifluoromethyl)phenyl]propyl}piperazine
Database identifiers
- CAS
519139-55-0- PubChem CID
- 3961827
- DTXSID
DTXSID601219999
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 274
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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