| CAS Number | 1805590-93-5 |
| Catalog Number | AG01FR12(AGN-PC-3H5PD6) |
| Chemical Name | 5-Bromo-4-fluoropyridin-2(1H)-one |
| IUPAC Name | 5-bromo-4-fluoro-1H-pyridin-2-one |
| InChI | InChI=1S/C5H3BrFNO/c6-3-2-8-5(9)1-4(3)7/h1-2H,(H,8,9) |
| InChI Key | LVXILRPCHMEDCE-UHFFFAOYSA-N |
| MDL Number | MFCD28739491 |
| Molecular Formula | C5H3BrFNO |
| Molecular Weight | 191.9858 |
| SMILES | O=C1C=C(F)C(Br)=CN1 |
| Synonyms | 5-Bromo-4-fluoro-2-hydroxypyridine,
1805590-93-5,
SCHEMBL17129557,
SCHEMBL20157698,
5-bromo-4-fluoropyridin-2(1H)-one,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.9382g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.99g/mol |
| Monoisotopic Mass | 190.9382g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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Certificate of Analysis
Lot Number