| CAS Number | 1176419-65-0 |
| Catalog Number | AG01A8GT |
| Chemical Name | 3-phenoxy-1-(piperazin-1-yl)propan-1-one hydrochloride |
| IUPAC Name | 3-phenoxy-1-piperazin-1-ylpropan-1-one;hydrochloride |
| InChI | InChI=1S/C13H18N2O2.ClH/c16-13(15-9-7-14-8-10-15)6-11-17-12-4-2-1-3-5-12;/h1-5,14H,6-11H2;1H |
| InChI Key | UCRRWSQZSNYFJI-UHFFFAOYSA-N |
| MDL Number | MFCD08444050 |
| Molecular Formula | C13H19ClN2O2 |
| Molecular Weight | 270.7552 |
| SMILES | Cl.O=C(N1CCNCC1)CCOC1=CC=CC=C1 |
| Synonyms | 3-phenoxy-1-(piperazin-1-yl)propan-1-one hydrochloride,
80385-33-7,
1176419-65-0,
3-Phenoxy-1-piperazin-1-yl-propan-1-onehydrochloride,
AC1Q3DZM,
MFCD08444050,
AKOS008090260,
FS-5620,
MCULE-2009360058,
NE59449,
FT-0712285,
EN300-61579,
1-Piperazin-1-yl-3-phenoxy-propan-1-one HCl,
3-Phenoxy-1-piperazin-1-yl-propan-1-one HCl,
3-Phenoxy-1-piperazin-1-yl-propan-1-one hydrochloride,
Z234898175,
1-PIPERAZIN-1-YL-3-PHENOXY-PROPAN-1-ONE HYDROCHLORIDE,
3-PHENOXY-1-PIPERAZIN-1-YL-PROPAN-1-ONE X HCL >98%,
3-Phenoxy-1-piperazin-1-yl-propan-1-one x HCl, 98% - 1G 1g,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.114g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.757g/mol |
| Monoisotopic Mass | 270.114g/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