| CAS Number | 1235439-06-1 |
| Catalog Number | AG01A8S4 |
| Chemical Name | 2-Cyclohexyl-1-(piperazin-1-yl)ethan-1-one hydrochloride |
| IUPAC Name | 2-cyclohexyl-1-piperazin-1-ylethanone;hydrochloride |
| InChI | InChI=1S/C12H22N2O.ClH/c15-12(14-8-6-13-7-9-14)10-11-4-2-1-3-5-11;/h11,13H,1-10H2;1H |
| InChI Key | HXLNZLZVZVPLHQ-UHFFFAOYSA-N |
| MDL Number | MFCD16040165 |
| Molecular Formula | C12H23ClN2O |
| Molecular Weight | 246.7768 |
| SMILES | Cl.O=C(N1CCNCC1)CC1CCCCC1 |
| Synonyms | 2-cyclohexyl-1-(piperazin-1-yl)ethan-1-one hydrochloride,
1235439-06-1,
AC1Q3DZB,
AKOS026859651,
NE27393,
EN300-62427,
|
| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.15g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.779g/mol |
| Monoisotopic Mass | 246.15g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number