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Chemical Structure| 6702-50-7 Chemical Structure| 6702-50-7
Chemical Structure| 6702-50-7

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Product Details of Methyl isovanillate

CAS No. :6702-50-7
Formula : C9H10O4
M.W : 182.17
SMILES Code : COC(C1=CC(=C(C=C1)OC)O)=O
English Name :Methyl 3-hydroxy-4-methoxybenzoate
MDL No. :MFCD01321262
InChI Key :QXOXUEFXRSIYSW-UHFFFAOYSA-N
Pubchem ID :4056967

Safety of Methyl isovanillate

Application In Synthesis of Methyl isovanillate

* 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 [ 6702-50-7 ]

[ 6702-50-7 ] Synthesis Path-Downstream   1~9

  • 2
  • [ 6702-50-7 ]
  • [ 214470-85-6 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: 80 percent / K2CO3 / dimethylformamide / 9 h / 100 °C 2: HNO3; glacial AcOH / 0.75 h / 50 - 60 °C 3: Fe; aq. NH4Cl / methanol / 19 h / Heating
Multi-step reaction with 3 steps 1: potassium carbonate / N,N-dimethyl-formamide / 7.5 h / 100 °C 2: nitric acid; acetic acid / 1 h / 55 °C 3: iron; ammonium chloride / methanol; water / 19 h / Heating / reflux
  • 4
  • [ 6702-50-7 ]
  • [ 51012-64-7 ]
  • 4-methoxy-3-(2-oxo-2-m-tolyl-ethoxy)-benzoic acid methyl ester [ No CAS ]
YieldReaction ConditionsOperation in experiment
With potassium carbonate; In methanol; at 20℃;Inert atmosphere; Step 1 : 4-Methoxy-3-(2-oxo-2-m-tolyl-ethoxy)-benzoic acid methyl ester 3-Hydroxy-4-methoxybenzoic acid methyl ester (2.50 g, 13.7 mmol) was dissolved in methanol (20 ml), potassium carbonate (3.72 g, 27.4 mmol) and 2-bromo-1 -m-tolyl- ethanone (2.92 g, 13.7 mmol) were added and the mixture was stirred overnight at room temperature. The volatiles were evaporated, the crude material was partitioned between EA and water, the aqueous phase was extracted with EA, the combined organic phases were dried over sodium sulfate and evaporated to dryness. The residue was purified by preparative RP HPLC (water/ACN gradient) to yield the title compound.LC/MS (Method LC2): Rt = 1 .57 min; m/z = 315.17 [MH+]
  • 5
  • [ 6702-50-7 ]
  • [ 159783-29-6 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: potassium carbonate / N,N-dimethyl-formamide / 3 h / 50 °C / Inert atmosphere 2: lithium hydroxide monohydrate / water; tetrahydrofuran / 12 h / 25 °C
Multi-step reaction with 2 steps 1: potassium carbonate / N,N-dimethyl-formamide / 10 h / 80 °C 2: sodium hydroxide / water; ethanol / 2 h / 50 °C
  • 7
  • [ 6702-50-7 ]
  • [ 179688-53-0 ]
  • 8
  • [ 6702-50-7 ]
  • [ 838856-88-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 5 steps 1.1: sodium acetate / 20 h / 20 °C 2.1: sulfuric acid; nitric acid / water / 0.42 h / -5 °C 3.1: hydrogen / 10% Pd/C / ethyl acetate / 24 h / 760.05 Torr 4.1: boron trifluoride diethyl etherate / 1,2-dimethoxyethane / 0.02 - 0.03 h / 0 °C 4.2: 0.25 h / 0 °C 5.1: 1,2,4-Trichlorobenzene / 17 h / 110 °C
  • 9
  • [ 6702-50-7 ]
  • [ 253168-94-4 ]
 

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