| CAS Number | 1458137-04-6 |
| Catalog Number | AG01EHVG |
| Chemical Name | N-(4-methoxyphenyl)piperazine-1-carboxamide hydrochloride |
| IUPAC Name | N-(4-methoxyphenyl)piperazine-1-carboxamide;hydrochloride |
| InChI | InChI=1S/C12H17N3O2.ClH/c1-17-11-4-2-10(3-5-11)14-12(16)15-8-6-13-7-9-15;/h2-5,13H,6-9H2,1H3,(H,14,16);1H |
| InChI Key | NNRCNCZCTJSBRV-UHFFFAOYSA-N |
| MDL Number | MFCD31369360 |
| Molecular Formula | C12H18ClN3O2 |
| Molecular Weight | 271.7432 |
| SMILES | Cl.COC1=CC=C(NC(N2CCNCC2)=O)C=C1 |
| Synonyms | N-(4-methoxyphenyl)piperazine-1-carboxamide hydrochloride,
1458137-04-6,
|
| Complexity | 246 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.109g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.745g/mol |
| Monoisotopic Mass | 271.109g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 53.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number