| CAS Number | 1239510-82-7 |
| Catalog Number | AG01DCRI(AGN-PC-0WNODB) |
| Chemical Name | 5-fluoro-6-hydroxypicolinonitrile |
| IUPAC Name | 5-fluoro-6-oxo-1H-pyridine-2-carbonitrile |
| InChI | InChI=1S/C6H3FN2O/c7-5-2-1-4(3-8)9-6(5)10/h1-2H,(H,9,10) |
| InChI Key | ONPYRZSDSGLGKI-UHFFFAOYSA-N |
| MDL Number | MFCD28768731 |
| Molecular Formula | C6H3FN2O |
| Molecular Weight | 138.0992 |
| SMILES | N#CC1=CC=C(F)C(=O)N1 |
| Synonyms | 1239510-82-7,
5-fluoro-6-hydroxypicolinonitrile,
5-Fluoro-6-oxo-1,6-dihydropyridine-2-carbonitrile,
2-Pyridinecarbonitrile, 5-fluoro-1,6-dihydro-6-oxo-,
SCHEMBL17603120,
ONPYRZSDSGLGKI-UHFFFAOYSA-N,
AKOS032949530,
FT-0700906,
5-Fluoro-1,6-dihydro-6-oxo-2-pyridinecarbonitrile,
|
| Complexity | 281 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 138.023g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 138.101g/mol |
| Monoisotopic Mass | 138.023g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 52.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number