| CAS Number | 1881291-71-9 |
| Catalog Number | AG00I241(AGN-PC-0WR8EY) |
| Chemical Name | 3-Fluoropyridin-4-ol hydrate |
| IUPAC Name | 3-fluoro-1H-pyridin-4-one;hydrate |
| InChI | InChI=1S/C5H4FNO.H2O/c6-4-3-7-2-1-5(4)8;/h1-3H,(H,7,8);1H2 |
| InChI Key | MTKCYWGVWVQVRY-UHFFFAOYSA-N |
| MDL Number | MFCD04114240 |
| Molecular Formula | C5H6FNO2 |
| Molecular Weight | 131.1050 |
| SMILES | Oc1ccncc1F.O |
| Synonyms | 3-FLUOROPYRIDIN-4-OL HYDRATE,
1881291-71-9,
|
| Complexity | 171 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 131.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 131.106g/mol |
| Monoisotopic Mass | 131.038g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 30.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number