| CAS Number | 512775-15-4 |
| Catalog Number | AG019LCC(AGN-PC-0WO1P3) |
| Chemical Name | 1-[1-(2-chlorophenyl)ethyl]piperazine |
| IUPAC Name | 1-[1-(2-chlorophenyl)ethyl]piperazine |
| InChI | InChI=1S/C12H17ClN2/c1-10(15-8-6-14-7-9-15)11-4-2-3-5-12(11)13/h2-5,10,14H,6-9H2,1H3 |
| InChI Key | JGFYDJGEOKSTPX-UHFFFAOYSA-N |
| MDL Number | MFCD05186117 |
| Molecular Formula | C12H17ClN2 |
| Molecular Weight | 224.7298 |
| SMILES | CC(C1=C(Cl)C=CC=C1)N1CCNCC1 |
| Synonyms | 1-[1-(2-chlorophenyl)ethyl]piperazine,
512775-15-4,
AC1MUGY9,
AC1Q2BF9,
CTK6H3143,
AKOS000126405,
AKOS022475687,
MCULE-5967075612,
NE38236,
EN300-30772,
Z228588078,
CID3640718,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.732g/mol |
| Monoisotopic Mass | 224.108g/mol |
| Rotatable Bond Count | 2 |
| 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