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Chemical Structure| 1015480-87-1 Chemical Structure| 1015480-87-1

Structure of 1015480-87-1

Chemical Structure| 1015480-87-1

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Product Details of [ 1015480-87-1 ]

CAS No. :1015480-87-1
Formula : C6H9BN2O4
M.W : 183.96
SMILES Code : COC1=NN=C(OC)C(B(O)O)=C1
MDL No. :MFCD10700157

Safety of [ 1015480-87-1 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302
Precautionary Statements:P264-P270-P301+P312+P330-P501

Application In Synthesis of [ 1015480-87-1 ]

* 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 [ 1015480-87-1 ]

[ 1015480-87-1 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 13195-50-1 ]
  • [ 1015480-87-1 ]
  • [ 1015480-92-8 ]
  • 2
  • [ 1015480-87-1 ]
  • [ 1000342-95-9 ]
  • [ 76-05-1 ]
  • 4-(3,6-dimethoxypyridazin-4-yl)-6-(trifluoromethyl)-1H-indazole trifluoroacetate [ No CAS ]
YieldReaction ConditionsOperation in experiment
4% EXAMPLE 248 : 4-(3 ,6-dimethoxypyridazin-4-yl)-6-(trifluoromethyl)- lH-indazole [0788] A vial was charged with a mixture of 4-bromo-6-(trifluoromethyl)-lH-indazole (0.15 g, 0.566 mmol),(3,6-dimethoxypyridazin-4-yl)boronic acid (0.135 g, 0.736 mmol) and PdCl2(dppf) (0.021 g, 0.028 mmol) in dioxane (10 mL) and aqueous saturated NaHC03 (3 mL). The resulting light brown suspension was heated at 140°C for 45 minutes in a microwave reactor. The reaction mixture was subsequently concentrated and the crude residue was purified by preparative HPLC, eluting with a gradient of 40-45percent ACN (containing 0.035percent TFA) in H20 (containing 0.05percent TFA) over a period of 6.5 minutes. The volatiles were removed in vacuo to give a TFA salt of the title compound as a light brown solid (8 mg, 4percent). 1H NMR (400 MHz, DMSO-d6) delta ppm 3.97 (s, 3 H), 4.03 (s, 3 H), 7.42 (s, 1 H), 7.55 (d, J=1.01 Hz, 1 H), 8.05 (s, 1 H), 8.14 (s, 1 H), 13.74 (s, 1 H); ESI-MS m/z [M+H]+ calc'd for Ci4HiiF3N402, 325.1; found 325.16.
 

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