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Chemical Structure| 70558-05-3 Chemical Structure| 70558-05-3

Structure of 70558-05-3

Chemical Structure| 70558-05-3

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Product Details of [ 70558-05-3 ]

CAS No. :70558-05-3
Formula : C11H22BNO3
M.W : 227.11
SMILES Code : CC1(C)C(C)(C)OB(CN2CCOCC2)O1
MDL No. :MFCD24448819
InChI Key :SULANVZCNXJDKS-UHFFFAOYSA-N
Pubchem ID :12489068

Safety of [ 70558-05-3 ]

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

Application In Synthesis of [ 70558-05-3 ]

* 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 [ 70558-05-3 ]

[ 70558-05-3 ] Synthesis Path-Downstream   1~6

  • 1
  • [ 110-91-8 ]
  • [ 70557-99-2 ]
  • [ 70558-05-3 ]
  • 2
  • [ 70558-04-2 ]
  • [ 76-09-5 ]
  • [ 70558-05-3 ]
  • 3
  • [ 66080-23-7 ]
  • [ 70558-05-3 ]
  • 4
  • [ 109-02-4 ]
  • [ 73183-34-3 ]
  • [ 70558-05-3 ]
  • C11H22BNO3 [ No CAS ]
  • C11H22BNO3 [ No CAS ]
  • 5
  • [ 109-02-4 ]
  • [ 73183-34-3 ]
  • [ 70558-05-3 ]
  • 6
  • [ 70558-05-3 ]
  • 3-benzyl-2-bromo-9-methyl-4H,6H-thieno[2,3-e][1,2,4]triazolo[3,4-c][1,4]oxazepine [ No CAS ]
  • 3-benzyl-9-methyl-2-(morpholinomethyl)-4H,6H-thieno[2,3-e][1,2,4]triazolo[3,4-c][1,4]oxazepine [ No CAS ]
YieldReaction ConditionsOperation in experiment
45% With tris-(dibenzylideneacetone)dipalladium(0); sodium carbonate; tricyclohexylphosphine; In 1,4-dioxane; at 100.0℃; for 4.0h;Schlenk technique; Inert atmosphere; Sealed tube; To a Shlenk tube was charged with Cpd. No. 31 (10 mg), 4-((4,4,5,5- tetramethyl-l,3,2-dioxaborolan-2-yl)methyl)morpholine (14 mg, 2 eq), Pd2(dba)3 (2.7 mg), PCy3 (1.7 mg), dioxane (1 mL) and Na2C03 solution (2 M, 0.5 mL) under N2. The tube was sealed and heated at 100 C oil bath for 4 h. The reaction mixture was extracted with EtOAc and the organic layer was washed with brine, dried and concentrated. The residue was purified through PLC to afford Cpd. No. 90 (45% yield). 1H NMR (400 MHz, MeOD) delta 7.34 (t, = 7.6 Hz, 2H), 7.26 (t, = 7.2 Hz, 1H), 7.13 (d, = 7.7 Hz, 2H), 4.74 (s, 2H), 4.72 (s, 2H), 4.67 (s, 2H), 4.17 (s, 2H), 3.92 (s, 4H), 3.36 (s, 4H), 2.80 (s, 3H). ESI-MS: M+H 397.10.
 

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