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Chemical Structure| 847606-79-5 Chemical Structure| 847606-79-5

Structure of 847606-79-5

Chemical Structure| 847606-79-5

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Product Details of [ 847606-79-5 ]

CAS No. :847606-79-5
Formula : C10H9N3O3
M.W : 219.20
SMILES Code : O=C(O)COC1=CC=CC(N2C=NN=C2)=C1
MDL No. :MFCD11983292

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Application In Synthesis of [ 847606-79-5 ]

* 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 [ 847606-79-5 ]

[ 847606-79-5 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 6274-24-4 ]
  • [ 628-36-4 ]
  • [ 847606-79-5 ]
YieldReaction ConditionsOperation in experiment
30% With toluene-4-sulfonic acid; In N,N-dimethyl-formamide; toluene;Heating / reflux; (3- [1, 2,4] Triazol-4-yl-phenoxy) -acetic acid 24: To a round bottom flask was added (3-amino-phenoxy) -acetic acid 2 (167 mg, 1.0 mmol, 1.0 eq. ), toluene (5.0 mL), DMF (0.5 mL), p-toluene sulfonic acid monohydrate (209 mg, 1.1 mmol, 1.1 eq. ), and SYM-DIFORMYL hydrazine (96.8 mg, 1.1 mmol, 1.1 eq. ). The mixture was refluxed overnight. Upon cooling to RT, the reaction mixture separated out into two layers with product in the bottom brown oil layer and toluene in the clear top layer. The toluene layer was removed; water was added to the brown oil and then extracted with EtOAc 3X. The combined organic layers were then dried with NA2S04, concentrated via rotary evaporation, and then triturated with ether to give (3- [1, 2,4] TRIAZOL-4-YL-PHENOXY)-ACETIC acid 24 as an orange solid (65.0 mg, 30percent yield). LC/MSD (HP Series 1100 MSD) MS (ES+) m/z 220.1 (M+H) +L IH-NMR, Varian 400 MHz (DMSO-d6) 8 9.10 (s, 2H), 7. 48 (m, 1H), 7.39 (t, 1H), 7.31 (dd, 1H), 7.00 (dd, 1H), 4. 80 (s, 2H) ppm.
 

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