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Chemical Structure| 22482-74-2 Chemical Structure| 22482-74-2

Structure of 22482-74-2

Chemical Structure| 22482-74-2

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Product Details of [ 22482-74-2 ]

CAS No. :22482-74-2
Formula : C9H7ClO4
M.W : 214.60
SMILES Code : O=C(O)C1=CC=CC(Cl)=C1CC(O)=O
MDL No. :MFCD19370530
InChI Key :HARZEJOUACLTDB-UHFFFAOYSA-N
Pubchem ID :66884655

Safety of [ 22482-74-2 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H315-H319
Precautionary Statements:P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Application In Synthesis of [ 22482-74-2 ]

* 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 [ 22482-74-2 ]

[ 22482-74-2 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 22482-74-2 ]
  • [ 94-98-4 ]
  • [ 721960-40-3 ]
YieldReaction ConditionsOperation in experiment
73% at 180℃; for 64h; A. A mixture of 2-CARBOXYMETHYL-3-CHLOROBENZOIC acid (1.91 g, 8.9 MMOL) and 2, 4-DIMETHYLBENZYLAMINE (1.35 mL, 9.6 MMOL) was placed in a vented vial and heated in an oil bath maintained at 180 C. After heating for 64 hours the reaction was allowed to cool to ambient temperature, then taken up in a mixture of CH2CI2, acetone, and methanol. The solution was mixed with silica gel and then concentrated under reduced pressure to afford a free flowing solid. This solid was loaded onto the top of a silica gel column and eluted with a gradient from 0% to 14% ethyl acetate/hexane to afford 5-CHLORO-2- (2, 4-DIMETHYLBENZYL)-4H-ISOQUINOLINE-1, 3-dione (2.03 g, 73 % yield) as a yellow solid : 1H-NMR (400 MHz, CDCI3) : 8 8.17 (1 H, dd, J = 7.8, 1.3 Hz), 7.65 (1 H, dd, J = 7.8, 1.3 Hz), 7.42 (1 H, app. t, J = 7.8 Hz), 6.98 (1 H, br s), 6.96-6. 92 (1H, m), 6.91-6. 87 (1H, m), 5.16 (2H, s), 4.09 (2H, s), 2.44 (3H, s), 2.26 (3H, s) ppm.
 

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