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Chemical Structure| 15965-55-6 Chemical Structure| 15965-55-6

Structure of 15965-55-6

Chemical Structure| 15965-55-6

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Product Details of [ 15965-55-6 ]

CAS No. :15965-55-6
Formula : C7H4ClN3O2
M.W : 197.58
SMILES Code : O=[N+](C1=C2NC(Cl)=NC2=CC=C1)[O-]
MDL No. :MFCD22562504
InChI Key :IDHWSFVCVDTHNI-UHFFFAOYSA-N
Pubchem ID :14765451

Safety of [ 15965-55-6 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 15965-55-6 ]

* 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 [ 15965-55-6 ]

[ 15965-55-6 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 182438-98-8 ]
  • [ 15965-55-6 ]
  • C27H22ClF3N4O3 [ No CAS ]
YieldReaction ConditionsOperation in experiment
60% With potassium carbonate; In DMF (N,N-dimethyl-formamide); at 20℃; for 64h; To a solution of Part B compound (2.785 g, 14.10 mmol) in 30 mL of anhydrous DMF was added 7.20 g (16.92 mmol) of Example 273 Part A(2) compound, followed by potassium carbonate (3.90g, 28.20 mmol). The resulting suspension was stirred at room temperature under argon for 64 hours, then partitioned between EtOAc/H2O. The aqueous phase was extracted with EtOAc (3X), the combined EtOAc extracts washed with water (3X), brine, dried over MgSO4. The filtrate was concentrated in vacuo to give a beige colored solid, which was triturated with EtOAc (2X), dried in air to yield 2.3 g of title compound as an off-white solid. The EtOAc washings were concentrated and the residue triturated with EtOAc, and the process repeated to afford 1.9 g more of title compound. The EtOAc washings from last trituration were concentrated and the residue absorbed on Celite, then chromatographed eluting with 20-50% EtOAc/hexane to give additional 0.4 g of title compound (total 4.6 g, 60% yield) as a light yellow solid.
 

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