5-Fluoro-6-hydroxypyrimidin-4(3H)-one - CAS 106615-61-6
Catalog: |
BB001895 |
Product Name: |
5-Fluoro-6-hydroxypyrimidin-4(3H)-one |
CAS: |
106615-61-6 |
Synonyms: |
5-fluoro-4-hydroxy-1H-pyrimidin-6-one; 5-fluoro-4-hydroxy-1H-pyrimidin-6-one |
IUPAC Name: | 5-fluoro-4-hydroxy-1H-pyrimidin-6-one |
Description: | 5-Fluoro-6-hydroxypyrimidin-4(3H)-one (CAS# 106615-61-6) is used in preparation of Phenylpyrimidine derivatives and analogs for use as Kynurenine-3-monooxygenase inhibitors. |
Molecular Weight: | 130.08 |
Molecular Formula: | C4H3FN2O2 |
Canonical SMILES: | C1=NC(=C(C(=O)N1)F)O |
InChI: | InChI=1S/C4H3FN2O2/c5-2-3(8)6-1-7-4(2)9/h1H,(H2,6,7,8,9) |
InChI Key: | XGSFAIWGUAFXSG-UHFFFAOYSA-N |
Boiling Point: | 295.4 °C at 760 mmHg |
Density: | 1.73 g/cm3 |
Storage: | Sealed in dry, 2-8 °C |
MDL: | MFCD09033260 |
LogP: | 0.02690 |
Publication Number | Title | Priority Date |
CN-109925589-B | Novel prostate expands and splits pipe | 20190305 |
CA-2987545-A1 | Improved process for preparing (e)-(5,6-dihydro-1,4,2-dioxazine-3-yl)(2-hydroxyphenyl)methanone o-methyl oxime | 20150529 |
EP-3303312-A1 | Process for preparing (e)-(5,6-dihydro-1,4,2-dioxazine-3-yl) (2-hydroxyphenyl) methanone o-methyl oxime | 20150529 |
JP-2018517696-A | Improved process to prepare (E)-(5,6-dihydro-1,4,2-dioxazin-3-yl) (2-hydroxyphenyl) methanone O-methyl oxime | 20150529 |
RU-2701862-C2 | Improved method of producing o-methyloxime (e)-(5,6-dihydro-1,4,2-dioxazin-3-yl)(2-hydroxyphenyl)methanone | 20150529 |
Complexity: | 209 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 130.0178555 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 130.0178555 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 61.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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