| CAS Number | 914482-23-8 |
| Catalog Number | AG003AMQ(AGN-PC-00JK6D) |
| Chemical Name | 3,5-Difluoro-2(1H)-pyridinone |
| IUPAC Name | 3,5-difluoro-1H-pyridin-2-one |
| InChI | InChI=1S/C5H3F2NO/c6-3-1-4(7)5(9)8-2-3/h1-2H,(H,8,9) |
| InChI Key | CQPCSKARWXNHPS-UHFFFAOYSA-N |
| MDL Number | MFCD13185555 |
| Molecular Formula | C5H3F2NO |
| Molecular Weight | 131.0802 |
| SMILES | FC=1C(NC=C(C1)F)=O |
| Synonyms | 914482-23-8,
3,5-difluoro-2-hydroxypyridine,
2(1H)-PYRIDINONE, 3,5-DIFLUORO-,
3,5-difluoropyridin-2-ol,
3,5-difluoro-1H-pyridin-2-one,
SCHEMBL20714876,
DTXSID40475576,
3,5-Difluoro-2(1H)-pyridinone,
ZINC72231317,
AKOS006377286,
AKOS027384132,
QC-7018,
CS-0060274,
CID12000513,
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| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 131.018g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 131.082g/mol |
| Monoisotopic Mass | 131.018g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
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