| CAS Number | 1354950-88-1 |
| Catalog Number | AG019S0J |
| Chemical Name | N-(4-methylphenyl)piperazine-1-carboxamide hydrochloride |
| IUPAC Name | N-(4-methylphenyl)piperazine-1-carboxamide;hydrochloride |
| InChI | InChI=1S/C12H17N3O.ClH/c1-10-2-4-11(5-3-10)14-12(16)15-8-6-13-7-9-15;/h2-5,13H,6-9H2,1H3,(H,14,16);1H |
| InChI Key | ZIPDTSGUFMBEMV-UHFFFAOYSA-N |
| MDL Number | MFCD20441726 |
| Molecular Formula | C12H18ClN3O |
| Molecular Weight | 255.7438 |
| SMILES | Cl.CC1=CC=C(NC(N2CCNCC2)=O)C=C1 |
| Synonyms | N-(4-methylphenyl)piperazine-1-carboxamide hydrochloride,
1354950-88-1,
MCULE-8214650965,
NE38822,
EN300-91322,
Z1266874220,
|
| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.114g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.746g/mol |
| Monoisotopic Mass | 255.114g/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