| CAS Number | 1803605-15-3 |
| Catalog Number | AG01BD2M(AGN-PC-0WOSKC) |
| Chemical Name | 1-(2-methylpentyl)piperidin-4-one hydrochloride |
| IUPAC Name | 1-(2-methylpentyl)piperidin-4-one;hydrochloride |
| InChI | InChI=1S/C11H21NO.ClH/c1-3-4-10(2)9-12-7-5-11(13)6-8-12;/h10H,3-9H2,1-2H3;1H |
| InChI Key | DHZRVIQHGOFKCI-UHFFFAOYSA-N |
| MDL Number | MFCD28012392 |
| Molecular Formula | C11H22ClNO |
| Molecular Weight | 219.7515 |
| SMILES | Cl.CCCC(CN1CCC(=O)CC1)C |
| Synonyms | 1-(2-methylpentyl)piperidin-4-one hydrochloride,
1803605-15-3,
AKOS026742514,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.139g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.753g/mol |
| Monoisotopic Mass | 219.139g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number