| CAS Number | 1170255-29-4 |
| Catalog Number | AG019MKZ(AGN-PC-0WCWWW) |
| Chemical Name | N-(3-chlorophenyl)piperazine-1-carboxamide hydrochloride |
| IUPAC Name | N-(3-chlorophenyl)piperazine-1-carboxamide;hydrochloride |
| InChI | InChI=1S/C11H14ClN3O.ClH/c12-9-2-1-3-10(8-9)14-11(16)15-6-4-13-5-7-15;/h1-3,8,13H,4-7H2,(H,14,16);1H |
| InChI Key | JXILOJFETPZDMQ-UHFFFAOYSA-N |
| MDL Number | MFCD10686902 |
| Molecular Formula | C11H15Cl2N3O |
| Molecular Weight | 276.1623 |
| SMILES | Cl.ClC1=CC(NC(N2CCNCC2)=O)=CC=C1 |
| Synonyms | N-(3-chlorophenyl)piperazine-1-carboxamide hydrochloride,
1170255-29-4,
AC1Q3B8Y,
CTK6H2785,
AKOS030236321,
MCULE-6101985649,
NE59159,
EN300-36475,
A1-04064,
Piperazine-1-carboxylic acid (3-chloro-phenyl)-amide; hydrochloride,
Piperazine-1-carboxylic acid (3-chlorophenyl)-amide hydrochloride,
|
| Complexity | 243 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 276.161g/mol |
| Monoisotopic Mass | 275.059g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 44.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number