| CAS Number | 1256792-13-8 |
| Catalog Number | AG01BBCT |
| Chemical Name | 1-(5-Fluoro-2-methoxypyridin-4-yl)ethanone |
| IUPAC Name | 1-(5-fluoro-2-methoxypyridin-4-yl)ethanone |
| InChI | InChI=1S/C8H8FNO2/c1-5(11)6-3-8(12-2)10-4-7(6)9/h3-4H,1-2H3 |
| InChI Key | JNTMAMXPICQOSW-UHFFFAOYSA-N |
| MDL Number | MFCD18258148 |
| Molecular Formula | C8H8FNO2 |
| Molecular Weight | 169.1530 |
| SMILES | COC1=NC=C(F)C(C(C)=O)=C1 |
| Synonyms | 1-(5-Fluoro-2-methoxypyridin-4-yl)ethanone,
1256792-13-8,
MFCD18258148,
ZINC238334074,
AS-36601,
1-(5-fluoro-2-methoxypyridin-4-yl)ethan-1-one,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.155g/mol |
| Monoisotopic Mass | 169.054g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number