| CAS Number | 516447-25-9 |
| Catalog Number | AG01BTKP |
| Chemical Name | 1-[1-(4-Fluorophenyl)propyl]piperazine |
| IUPAC Name | 1-[1-(4-fluorophenyl)propyl]piperazine |
| InChI | InChI=1S/C13H19FN2/c1-2-13(16-9-7-15-8-10-16)11-3-5-12(14)6-4-11/h3-6,13,15H,2,7-10H2,1H3 |
| InChI Key | PBWGKTIIMAHBGI-UHFFFAOYSA-N |
| MDL Number | MFCD05187180 |
| Molecular Formula | C13H19FN2 |
| Molecular Weight | 222.3018 |
| SMILES | CCC(C1=CC=C(F)C=C1)N1CCNCC1 |
| Synonyms | 1-[1-(4-fluorophenyl)propyl]piperazine,
516447-25-9,
1-(1-(4-fluorophenyl)propyl)piperazine,
AC1N03WE,
AKOS010288093,
Z2466069099,
CID3956817,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.153g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.307g/mol |
| Monoisotopic Mass | 222.153g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number