| CAS Number | 906745-06-0 |
| Catalog Number | AG019LER |
| Chemical Name | 1-[4-(benzyloxy)benzoyl]piperazine hydrochloride |
| IUPAC Name | (4-phenylmethoxyphenyl)-piperazin-1-ylmethanone;hydrochloride |
| InChI | InChI=1S/C18H20N2O2.ClH/c21-18(20-12-10-19-11-13-20)16-6-8-17(9-7-16)22-14-15-4-2-1-3-5-15;/h1-9,19H,10-14H2;1H |
| InChI Key | OJAQLFBLEKUFDE-UHFFFAOYSA-N |
| MDL Number | MFCD14705561 |
| Molecular Formula | C18H21ClN2O2 |
| Molecular Weight | 332.8245 |
| SMILES | Cl.O=C(C1=CC=C(OCC2=CC=CC=C2)C=C1)N1CCNCC1 |
| Synonyms | 1-[4-(benzyloxy)benzoyl]piperazine hydrochloride,
906745-06-0,
1-{[4-(benzyloxy)phenyl]carbonyl}piperazine hydrochloride,
AC1Q3E1M,
CTK7F7286,
AKOS025440142,
MCULE-5814108918,
NE15840,
EN300-30997,
Z1262254301,
1-([4-(benzyloxy)phenyl]carbonyl)piperazine hydrochloride,
|
| Complexity | 341 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 332.129g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 332.828g/mol |
| Monoisotopic Mass | 332.129g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 41.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number