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Chemical Structure| 1036389-05-5 Chemical Structure| 1036389-05-5

Structure of 1036389-05-5

Chemical Structure| 1036389-05-5

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Product Details of [ 1036389-05-5 ]

CAS No. :1036389-05-5
Formula : C8H7BrFNO2
M.W : 248.05
SMILES Code : O=C(C1=CC(N)=CC(F)=C1Br)OC
MDL No. :MFCD24119832
InChI Key :LBZFEFCDWYLWCF-UHFFFAOYSA-N
Pubchem ID :68759053

Safety of [ 1036389-05-5 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H315-H319
Precautionary Statements:P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362

Application In Synthesis of [ 1036389-05-5 ]

* 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 [ 1036389-05-5 ]

[ 1036389-05-5 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 67-56-1 ]
  • [ 881415-28-7 ]
  • [ 881415-27-6 ]
  • [ 1036389-05-5 ]
  • [ 1036390-96-1 ]
YieldReaction ConditionsOperation in experiment
9A (3.7g, 14 mmol) was refluxed for 1 h in thionyl chloride (15 mL) and concentrated to an oil. MeOH (40 mL) was added slowly to the residue and the mixture refluxed for 1 h. The reaction was concentrated to dryness. The residue was heated at 90 0C for 4 h in acetic acid (20 mL) with a Fe powder (365 mg, 6.7 mmol). Upon cooling to rt the reaction was diluted with EtOAc (100 mL) and the resulting mixture filtered through Celite . The filter cake was washed with EtOAc (3 x 100 mL). The combined organics were washed with water and brine, dried w/ MgSO4 and concentrated to give 9B (2.Og, 54% yield) in a 1: 1 mixture with a regioisomers. MS (ESI) mk 248.1 (M+H)
 

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