| CAS Number | 57238-82-1 |
| Catalog Number | AG019NQD(AGN-PC-0SN812) |
| Chemical Name | 1-(2-Chlorobenzoyl)piperazine hydrochloride |
| IUPAC Name | (2-chlorophenyl)-piperazin-1-ylmethanone;hydrochloride |
| InChI | InChI=1S/C11H13ClN2O.ClH/c12-10-4-2-1-3-9(10)11(15)14-7-5-13-6-8-14;/h1-4,13H,5-8H2;1H |
| InChI Key | DNSJPAKXQUGKEV-UHFFFAOYSA-N |
| MDL Number | MFCD08445283 |
| Molecular Formula | C11H14Cl2N2O |
| Molecular Weight | 261.1477 |
| SMILES | Cl.ClC1=C(C(N2CCNCC2)=O)C=CC=C1 |
| Synonyms | 1-(2-chlorobenzoyl)piperazine hydrochloride,
57238-82-1,
(2-Chlorophenyl)-1-piperazinyl-methanone hydrochloride,
AC1Q3B88,
CTK8F2654,
AKOS025658704,
NE59923,
EN300-11504,
(2-chlorophenyl)(piperazin-1-yl)methanone hydrochloride,
(2-Chlorophenyl)(piperazin-1- yl)methanone hydrochloride,
13754-45-5,
|
| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 260.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 261.146g/mol |
| Monoisotopic Mass | 260.048g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number