| CAS Number | 2092204-97-0 |
| Catalog Number | AG01E914 |
| Chemical Name | 3-acetyl-1-phenylpiperidin-2-one |
| IUPAC Name | 3-acetyl-1-phenylpiperidin-2-one |
| InChI | InChI=1S/C13H15NO2/c1-10(15)12-8-5-9-14(13(12)16)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-9H2,1H3 |
| InChI Key | PILPATAVOYVCMA-UHFFFAOYSA-N |
| MDL Number | MFCD31667136 |
| Molecular Formula | C13H15NO2 |
| Molecular Weight | 217.2637 |
| SMILES | CC(C1C(=O)N(C2=CC=CC=C2)CCC1)=O |
| Synonyms | 3-acetyl-1-phenylpiperidin-2-one,
2092204-97-0,
|
| Complexity | 282 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.268g/mol |
| Monoisotopic Mass | 217.11g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number