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Chemical Structure| 1257069-38-7 Chemical Structure| 1257069-38-7

Structure of 1257069-38-7

Chemical Structure| 1257069-38-7

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Product Details of [ 1257069-38-7 ]

CAS No. :1257069-38-7
Formula : C5H5FN2O
M.W : 128.10
SMILES Code : OC1=NC=C(F)C=C1N
MDL No. :MFCD19216201
InChI Key :ZNMZQYAQKSDACX-UHFFFAOYSA-N
Pubchem ID :53217434

Safety of [ 1257069-38-7 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Application In Synthesis of [ 1257069-38-7 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 1257069-38-7 ]

[ 1257069-38-7 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 136888-20-5 ]
  • [ 1257069-38-7 ]
YieldReaction ConditionsOperation in experiment
58.5% With palladium 10% on activated carbon; hydrogen; In ethanol; at 20℃; for 2h; 5-Fluoro-3-nitropyridin-2-ol (10 g, 63.3 mmol) was dissolved in ethanol (300 mL), 1 0% Pd/C (1 .8 g) was added and the mixture wasstirred at room temperature under atmospheric pressure of hydrogen for2 h. Pd/C was removed by filtration and the solvent was evaporated invacuum to obtain the title compound as an off-white solid (7,5 g, 58.5mmol, Y=92%). LC-MS (M-H) = 129.0
Step 4. 3-amino-5-fluoropyridin-2-olA mixture of <strong>[136888-20-5]5-fluoro-3-nitropyridin-2-ol</strong> (73 mg, 0.46 mmol; prepared according to procedure reported in WO 2006/114706) and iron (130 mg, 2.3 mmol), in ethanol (1.0 mL), acetic acid (0.76 mL), water (0.38 mL) and c. HCl (1 drop) was heated to 100 C. for 20 min. After cooling to RT, the solution was diluted with water (10 mL), filtered, and the filtrate was concentrated. The residue was then treated with saturated sodium bicarbonate solution to near pH 7, and the product was extracted with 6×40 mL of 20% isopropanol/DCM. The extracts were dried over sodium sulfate, filtered and concentrated and the product was used without further purification in the following step. LCMS (M+H)+: 129.0.
 

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