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Chemical Structure| 94940-35-9 Chemical Structure| 94940-35-9

Structure of 94940-35-9

Chemical Structure| 94940-35-9

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Product Details of [ 94940-35-9 ]

CAS No. :94940-35-9
Formula : C12H9F2OP
M.W : 238.17
SMILES Code : FC1=CC=C(P(C2=CC=C(F)C=C2)=O)C=C1
MDL No. :N/A
InChI Key :MIYITCTXDGORJJ-UHFFFAOYSA-N
Pubchem ID :13332985

Safety of [ 94940-35-9 ]

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H315-H317-H319-H335-H360
Precautionary Statements:P201-P261-P280-P305+P351+P338-P308+P313
Class:6.1
UN#:2811
Packing Group:

Application In Synthesis of [ 94940-35-9 ]

* 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 [ 94940-35-9 ]

[ 94940-35-9 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 19955-99-8 ]
  • [ 94940-35-9 ]
  • 3-(2-(bis(4-fluorophenyl)phosphoryl)-1-chloroethyl)benzaldehyde [ No CAS ]
YieldReaction ConditionsOperation in experiment
65% General procedure: An oven-dried, 10 mL two-neck glass tube was equipped with a magnetic stir bar, a rubber septum, a Teflon cap fitted with electrical feed-throughs, a carbon felt anode (1.0 × 0.5 cm2) (connected to the electrical feed through via a 9 cm in length, 2 mm in diameter graphite rod), and a platinum foil cathode (0.5 × 1.0 cm2). To this reaction vessel, bipy (1.9 mg, 0.012 mmol, 6 mol%), Mn(OTf)2 (3.6 mg, 0.01 mmol, 5 mol%), phosphorous source (0.2 mmol, 1.0 equiv), and lithium chloride (17.0 mg, 0.4 mmol, 2.0 equiv) was added. The cell was sealed, 3 mL of electrolyte solution (0.10 M LiClO4 in acetonitrile) were added, and the mixture was flushed with nitrogen gas for 5 minutes, followed by the addition via syringe of a mixture of olefin substrate (0.2 mmol,1.0 equiv), 0.5 mL electrolyte solution, and acetic acid (0.40 mL). A nitrogen-filled balloon was adapted through the septum to sustain a nitrogen atmosphere. Electrolysis was initiated at a constant cell voltage of 2.3 V at 22 C. Reaction was stopped after 3.0 F charge was passed. The entire reaction mixture was then transferred to a short silica gel column (7-10 cm in length, ca. 10g) and flushed through with 100 mL of 1:1 mixture of hexanes and acetone to eliminate the inorganic salts, and the product solution was concentrated in vacuo. The residue was subjected to flash column chromatography on silica gel (eluted with hexanes/ethyl acetate) to yield the pure product.
 

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