| CAS Number | 167864-96-2 |
| Catalog Number | AG01B56Z |
| Chemical Name | 1-(2-Aminophenyl)piperidin-2-one |
| IUPAC Name | 1-(2-aminophenyl)piperidin-2-one |
| InChI | InChI=1S/C11H14N2O/c12-9-5-1-2-6-10(9)13-8-4-3-7-11(13)14/h1-2,5-6H,3-4,7-8,12H2 |
| InChI Key | QDVSRWSFNKRYCC-UHFFFAOYSA-N |
| MDL Number | MFCD09805334 |
| Molecular Formula | C11H14N2O |
| Molecular Weight | 190.2417 |
| SMILES | NC1=C(N2C(=O)CCCC2)C=CC=C1 |
| Synonyms | 1-(2-aminophenyl)piperidin-2-one,
167864-96-2,
2-Piperidinone, 1-(2-aminophenyl)-,
ZINC19415899,
AKOS000169474,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.246g/mol |
| Monoisotopic Mass | 190.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number