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Chemical Structure| 58483-97-9 Chemical Structure| 58483-97-9

Structure of 58483-97-9

Chemical Structure| 58483-97-9

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Product Details of [ 58483-97-9 ]

CAS No. :58483-97-9
Formula : C6H6ClN3O
M.W : 171.58
SMILES Code : O=C(N)C1=C(N)N=CC(Cl)=C1
MDL No. :MFCD18260978
InChI Key :JFNZMPQWXSLMHC-UHFFFAOYSA-N
Pubchem ID :66876883

Safety of [ 58483-97-9 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H315-H319
Precautionary Statements:P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362

Application In Synthesis of [ 58483-97-9 ]

* 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 [ 58483-97-9 ]

[ 58483-97-9 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 58483-97-9 ]
  • [ 50712-69-1 ]
  • [ 1021873-80-2 ]
YieldReaction ConditionsOperation in experiment
Example 187 5-chloro-1-(4-chloro-2-cyanobenzyl)-2-imino-1,2-dihydropyridine-3-carboxamide hydrochloride To a solution of 2-amino-5-chloronicotinamide (0.16 g) in N,N-dimethylformamide (3 ml) was added <strong>[50712-69-1]2-(bromomethyl)-5-chlorobenzonitrile</strong> (0.32 g), and the mixture was stirred at 100C for 14 hr. The reaction mixture was quenched with saturated aqueous sodium hydrogen carbonate solution and extracted with ethyl acetate. The extract was washed with saturated brine and dried over anhydrous magnesium sulfate. The solvent was evaporated under reduced pressure, and the obtained residue was purified by silica gel chromatography (ethyl acetate:hexane=3:2 - 4:1). 2N Hydrochloric acid-methanol solution (1 ml) was added to the obtained yellow oil at room temperature, and the obtained precipitate was recrystallized from methanol-ethyl acetate to give the title compound (3 mg). 1H-NMR (DMSO-d6) d ppm 5.75 (2H, s), 7.24 (1H, d, J=2.0 Hz), 7.68 (1H, dd, J=8.3, 2.0 Hz), 8.05 (1H, d, J=8.3 Hz), 8.23 (1H, s), 8.60-8.78 (3H, m), 9.38-9.81 (2H, m).
 

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