| CAS Number | 1208420-34-1 |
| Catalog Number | AG019X7L(AGN-PC-0WODAS) |
| Chemical Name | 1-[3-(2,2,2-trifluoroethoxy)propyl]piperazine |
| IUPAC Name | 1-[3-(2,2,2-trifluoroethoxy)propyl]piperazine |
| InChI | InChI=1S/C9H17F3N2O/c10-9(11,12)8-15-7-1-4-14-5-2-13-3-6-14/h13H,1-8H2 |
| InChI Key | ILEHMOSNWBSNBQ-UHFFFAOYSA-N |
| MDL Number | MFCD13196031 |
| Molecular Formula | C9H17F3N2O |
| Molecular Weight | 226.2393 |
| SMILES | FC(COCCCN1CCNCC1)(F)F |
| Synonyms | 1-[3-(2,2,2-trifluoroethoxy)propyl]piperazine,
1208420-34-1,
1-(3-(2,2,2-Trifluoroethoxy)propyl)piperazine,
AC1Q4KCR,
CTK7B7232,
ZINC38342287,
AKOS010632806,
MCULE-1880953992,
NE36497,
EN300-54275,
Z818727394,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.129g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.243g/mol |
| Monoisotopic Mass | 226.129g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 24.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number