| CAS Number | 1111109-59-1 |
| Catalog Number | AG00HBXU(AGN-PC-0WR4OQ) |
| Chemical Name | 5-(2-Fluoro-5-methylphenyl)-2-hydroxypyridine |
| IUPAC Name | 5-(2-fluoro-5-methylphenyl)-1H-pyridin-2-one |
| InChI | InChI=1S/C12H10FNO/c1-8-2-4-11(13)10(6-8)9-3-5-12(15)14-7-9/h2-7H,1H3,(H,14,15) |
| InChI Key | WYPNBYIIJCDTAE-UHFFFAOYSA-N |
| MDL Number | MFCD11876519 |
| Molecular Formula | C12H10FNO |
| Molecular Weight | 203.2123 |
| SMILES | Cc1ccc(c(c1)c1ccc(=O)[nH]c1)F |
| Synonyms | 1111109-59-1,
5-(2-FLUORO-5-METHYLPHENYL)-2-HYDROXYPYRIDINE,
DTXSID70682630,
MFCD11876519,
ZINC65337787,
K-0787,
5-(2-Fluoro-5-methylphenyl)pyridin-2(1H)-one,
5-(2-fluoro-5-methylphenyl)-1H-pyridin-2-one,
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| Complexity | 322 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.216g/mol |
| Monoisotopic Mass | 203.075g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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