| CAS Number | 1261895-92-4 |
| Catalog Number | AG00HJRJ(AGN-PC-0WR4V0) |
| Chemical Name | 4-(4-Carboxy-3-fluorophenyl)-2-hydroxypyridine |
| IUPAC Name | 2-fluoro-4-(2-oxo-1H-pyridin-4-yl)benzoic acid |
| InChI | InChI=1S/C12H8FNO3/c13-10-5-7(1-2-9(10)12(16)17)8-3-4-14-11(15)6-8/h1-6H,(H,14,15)(H,16,17) |
| InChI Key | PSQUIRHEVMTHOJ-UHFFFAOYSA-N |
| MDL Number | MFCD18312300 |
| Molecular Formula | C12H8FNO3 |
| Molecular Weight | 233.1952 |
| SMILES | Oc1nccc(c1)c1ccc(c(c1)F)C(=O)O |
| Synonyms | 1261895-92-4,
4-(4-CARBOXY-3-FLUOROPHENYL)-2-HYDROXYPYRIDINE,
2-Fluoro-4-(2-hydroxypyridin-4-yl)benzoic acid,
DTXSID70682973,
MFCD18312300,
K-2189,
2-Fluoro-4-(2-oxo-1,2-dihydropyridin-4-yl)benzoic acid,
2-fluoro-4-(2-oxo-1H-pyridin-4-yl)benzoic acid,
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| Complexity | 403 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.198g/mol |
| Monoisotopic Mass | 233.049g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 66.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
Lot Number