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[ CAS No. 1433990-64-7 ]

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2D
Chemical Structure| 1433990-64-7
Chemical Structure| 1433990-64-7
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Product Details of [ 1433990-64-7 ]

CAS No. :1433990-64-7MDL No. :MFCD28733865
Formula : C7H3BrClFO Boiling Point : -
Linear Structure Formula :-InChI Key :-
M.W :237.45Pubchem ID :86683773
Synonyms :

Computed Properties of [ 1433990-64-7 ]

TPSA : - H-Bond Acceptor Count : -
XLogP3 : - H-Bond Donor Count : -
SP3 : - Rotatable Bond Count : -

Safety of [ 1433990-64-7 ]

Signal Word:WarningClass:N/A
Precautionary Statements:P261-P305+P351+P338UN#:N/A
Hazard Statements:H302-H315-H319-H335Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 1433990-64-7 ]

  • Downstream synthetic route of [ 1433990-64-7 ]

[ 1433990-64-7 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 1346674-23-4 ]
  • [ 1433990-64-7 ]
  • [ 1433990-49-8 ]
YieldReaction ConditionsOperation in experiment
50% With tris-(dibenzylideneacetone)dipalladium(0); potassium acetate; 4,5-bis(diphenylphos4,5-bis(diphenylphosphino)-9,9-dimethylxanthenephino)-9,9-dimethylxanthene; In 1,4-dioxane; at 80℃; for 5h;Inert atmosphere; Example 128a 2-Bromo-6-{4,4-dimethyl-9-oxo-1,10-diazatricyclo[6.4.0.02,6]dodeca-2(6),7-dien-10-yl}-4-fluorobenzaldehyde 128a A 100-mL round-bottomed flask equipped with a reflux condenser was charged with <strong>[1346674-23-4]4,4-dimethyl-1,10-diazatricyclo[6.4.0.02,6]dodeca-2(6),7-dien-9-one</strong> 103e (1.0 g, 4.90 mmol, 1.0 eq.), 2-bromo-6-chloro-4-fluorobenzaldehyde (2.76 g, 9.8 mmol, 2.0 eq.), Pd2(dba)3 (224 mg, 0.24 mmol, 0.050 eq.), Xantphos (283 mg, 0.49 mmol, 0.10 eq.), potassium acetate (1.44 g, 14.7 mmol, 3.0 eq.), and 1,4-dioxane (50 mL). The system was evacuated and refilled with N2. The reaction mixture was heated at 80 C. for 5 h. After this time the reaction was cooled to room temperature and filtered. The filtrate was concentrated under reduced pressure and the residue was purified on silica-gel column eluting with 80:1 dichloromethane/methanol to afford 128a as a yellow solid (992 mg, 50%). MS: [M+H]+ 405.1
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