| CAS Number | 1556053-75-8 |
| Catalog Number | AG01B8J2 |
| Chemical Name | 1-(4-chloropyridin-2-yl)pyrrolidin-2-one |
| IUPAC Name | 1-(4-chloropyridin-2-yl)pyrrolidin-2-one |
| InChI | InChI=1S/C9H9ClN2O/c10-7-3-4-11-8(6-7)12-5-1-2-9(12)13/h3-4,6H,1-2,5H2 |
| InChI Key | FAVUAWPFSSGESG-UHFFFAOYSA-N |
| MDL Number | MFCD28348083 |
| Molecular Formula | C9H9ClN2O |
| Molecular Weight | 196.6336 |
| SMILES | ClC1=CC(N2C(=O)CCC2)=NC=C1 |
| Synonyms | 1-(4-chloropyridin-2-yl)pyrrolidin-2-one,
1556053-75-8,
ZINC108365758,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.634g/mol |
| Monoisotopic Mass | 196.04g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number