| CAS Number | 1256080-98-4 |
| Catalog Number | AG019G66(AGN-PC-0WNN9I) |
| Chemical Name | 3,3-Difluoro-5-hydroxypiperidin-2-one |
| IUPAC Name | 3,3-difluoro-5-hydroxypiperidin-2-one |
| InChI | InChI=1S/C5H7F2NO2/c6-5(7)1-3(9)2-8-4(5)10/h3,9H,1-2H2,(H,8,10) |
| InChI Key | IGLPGCSKRIFQMC-UHFFFAOYSA-N |
| MDL Number | MFCD18433741 |
| Molecular Formula | C5H7F2NO2 |
| Molecular Weight | 151.1114 |
| SMILES | OC1CC(F)(F)C(=O)NC1 |
| Synonyms | 3,3-difluoro-5-hydroxypiperidin-2-one,
1256080-98-4,
SCHEMBL17630299,
IGLPGCSKRIFQMC-UHFFFAOYSA-N,
MFCD18433741,
3,3-Difluoro-5-hydroxy-2-piperidone,
AKOS006372456,
CS-W001369,
AS-54527,
3,3-Difluoro-5-hydroxypiperidin-2-one-D2003,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.113g/mol |
| Monoisotopic Mass | 151.044g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number