| CAS Number | 1443980-80-0 |
| Catalog Number | AG01A548(AGN-PC-0WO39P) |
| Chemical Name | 1-(5-Fluoropyridin-2-yl)propan-1-one |
| IUPAC Name | 1-(5-fluoropyridin-2-yl)propan-1-one |
| InChI | InChI=1S/C8H8FNO/c1-2-8(11)7-4-3-6(9)5-10-7/h3-5H,2H2,1H3 |
| InChI Key | ISOUOXUJXKRQBQ-UHFFFAOYSA-N |
| MDL Number | MFCD22724373 |
| Molecular Formula | C8H8FNO |
| Molecular Weight | 153.1536 |
| SMILES | CCC(C1=NC=C(F)C=C1)=O |
| Synonyms | 1-(5-fluoropyridin-2-yl)propan-1-one,
1443980-80-0,
ZINC86704466,
AKOS018280021,
NE42899,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.156g/mol |
| Monoisotopic Mass | 153.059g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number