| CAS Number | 111887-72-0 |
| Catalog Number | AG008REN(AGN-PC-00NVBB) |
| Chemical Name | Ethanone,1-(2-fluoro-4-pyridinyl)- |
| IUPAC Name | 1-(2-fluoropyridin-4-yl)ethanone |
| InChI | InChI=1S/C7H6FNO/c1-5(10)6-2-3-9-7(8)4-6/h2-4H,1H3 |
| InChI Key | OJYXKBMRTTZINQ-UHFFFAOYSA-N |
| MDL Number | MFCD09263924 |
| Molecular Formula | C7H6FNO |
| Molecular Weight | 139.1270 |
| SMILES | CC(C1=CC(F)=NC=C1)=O |
| Synonyms | 1-(2-FLUOROPYRIDIN-4-YL)ETHANONE,
111887-72-0,
1-(2-Fluoro-4-pyridinyl)ethanone,
Ethanone,1-(2-fluoro-4-pyridinyl)-,
1-(2-Fluoro-pyridin-4-yl)-ethanone,
1-(2-FLUOROPYRIDIN-4-YL)ETHAN-1-ONE,
4-Acetyl-2-fluoropyridine,
SCHEMBL1437180,
CTK8E2996,
OJYXKBMRTTZINQ-UHFFFAOYSA-N,
1-(2-fluoropyridin-4-yl)-ethanone,
MFCD09263924,
ZINC34143956,
AKOS006329760,
AB50237,
AJ-87157,
AS-36024,
TX-012759,
F90002,
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| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.129g/mol |
| Monoisotopic Mass | 139.043g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number