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[ CAS No. 852110-51-1 ] {[proInfo.proName]}

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Chemical Structure| 852110-51-1
Chemical Structure| 852110-51-1
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Product Details of [ 852110-51-1 ]

CAS No. :852110-51-1 MDL No. :MFCD14705074
Formula : C9H9BrO2 Boiling Point : -
Linear Structure Formula :- InChI Key :KDCRSIHHGGSDPJ-UHFFFAOYSA-N
M.W : 229.07 Pubchem ID :59858092
Synonyms :

Safety of [ 852110-51-1 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P261-P280-P305+P351+P338 UN#:N/A
Hazard Statements:H302-H315-H319-H332-H335 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 852110-51-1 ]

* 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.

  • Upstream synthesis route of [ 852110-51-1 ]

[ 852110-51-1 ] Synthesis Path-Upstream   1~3

  • 1
  • [ 17269-81-7 ]
  • [ 852110-51-1 ]
YieldReaction ConditionsOperation in experiment
63.6 mg
Stage #1: With 2,2,2-Trifluoroacetophenone; dihydrogen peroxide In acetonitrile; <i>tert</i>-butyl alcohol at 20℃; for 18 h; Green chemistry
Stage #2: With 1,8-diazabicyclo[5.4.0]undec-7-ene In dichloromethane at 60℃; for 1 h; Green chemistry
General procedure: The respective o-allylphenol 2 (0.40 mmol) was placed in a roundbottomed flask followed by consecutive addition of t-BuOH (0.4 mL), 2,2,2-trifluoro-1-phenylethanone (7.0 mg, 0.08 mmol), aqueous buffer solution (0.4 mL, 0.6 M K2CO3/4 × 10–4 M EDTA disodium salt), MeCN (0.64 mL, 6.40 mmol), and 30percent aq H2O2 (1.38 mL, 6.40 mmol).The reaction mixture was left stirring for 18 h. The crude product was dried (Na2SO4) and the solvent was removed in vacuo. The mixture was dissolved in CH2Cl2 (1.00 mL) followed by addition of DBU (54.0mg, 0.40 mmol). The mixture was stirred for 1 h at 60 °C and then purified by flash column chromatography (40–60percent EtOAc in PE) to afford the desired product 3.
Reference: [1] Tetrahedron, 2006, vol. 62, # 11, p. 2639 - 2647
[2] Patent: US2008/194672, 2008, A1, . Location in patent: Page/Page column 42-43
[3] Letters in Drug Design and Discovery, 2014, vol. 11, # 3, p. 375 - 379
[4] Synthesis (Germany), 2017, vol. 49, # 18, p. 4254 - 4260
  • 2
  • [ 95-56-7 ]
  • [ 852110-51-1 ]
Reference: [1] Tetrahedron, 2006, vol. 62, # 11, p. 2639 - 2647
[2] Letters in Drug Design and Discovery, 2014, vol. 11, # 3, p. 375 - 379
[3] Synthesis (Germany), 2017, vol. 49, # 18, p. 4254 - 4260
  • 3
  • [ 60333-75-7 ]
  • [ 852110-51-1 ]
Reference: [1] Tetrahedron, 2006, vol. 62, # 11, p. 2639 - 2647
[2] Letters in Drug Design and Discovery, 2014, vol. 11, # 3, p. 375 - 379
[3] Synthesis (Germany), 2017, vol. 49, # 18, p. 4254 - 4260
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