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Chemical Structure| 120014-30-4 Chemical Structure| 120014-30-4

Structure of ACHE-IN-38
CAS No.: 120014-30-4

Chemical Structure| 120014-30-4

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Product Details of [ 120014-30-4 ]

CAS No. :120014-30-4
Formula : C17H23NO3
M.W : 289.37
SMILES Code : O=C1C(CC2CCNCC2)CC3=C1C=C(OC)C(OC)=C3
MDL No. :MFCD08460096
InChI Key :PGBZORAISITZTF-UHFFFAOYSA-N
Pubchem ID :10446897

Safety of [ 120014-30-4 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302
Precautionary Statements:P280-P305+P351+P338

Application In Synthesis of [ 120014-30-4 ]

* 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 [ 120014-30-4 ]

[ 120014-30-4 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 54589-54-7 ]
  • [ 120014-30-4 ]
  • [ 1033718-29-4 ]
YieldReaction ConditionsOperation in experiment
74% With N-ethyl-N,N-diisopropylamine; In acetonitrile; at 20 - 60℃; for 12h; Example 2 Ethyl 3-((4-((5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl)piperidin-1-yl)methyl)benzoate 14a (Scheme 4) To a stirred solution of indanone 12 (0.001 mol) and DIEA (0.002 mol) in anhydrous acetonitrile (10 ml) was added a solution of halide 13a (0.0012 mol) in anhydrous acetonitrile (2 ml) at room temperature. The resulting mixture was heated at 55-60 C. for 12 hours. The progress of the reaction was monitored by TLC. The reaction mixture was concentrated on rotavapor and the residue was diluted with ethyl acetate (50 ml). The resulting ethyl acetate solution was washed with water, dried over anhydrous sodium sulfate (Na2SO4) and evaporated the solvent. The residue was purified by silica gel column chromatography using a gradient of 0 to 100% ethyl acetate and hexane to get the title indanone 14a in 74% yield (0.33 g) yield. 1H NMR (400 MHz, CDCl3): delta 1.33-1.28 (3H, m); 1.37 (3H, t, J=7.2 Hz); 1.51-1.42 (1H, m); 1.73-1.62 (2H, m); 1.99-1.85 (3H, m); 2.69-2.65 (2H, m); 2.88-2.83 (2H, broad t); 3.24-3.17 (1H, m); 3.52 (2H, s); 3.88 (3H, s); 3.93 (3H, s); 4.35 (2H, q, J=7.2 Hz); 6.83 (1H, s); 7.14 (1H, s); 7.36 (1H, td, J=7.6, 2.4 Hz); 7.52 (1H, broad d); 7.91 (1H, dd, J=7.6, 1.2 Hz); 7.94 (1H, m). MS (ESI): m/z=452.30 (M+H+).
  • 2
  • [ 17329-87-2 ]
  • [ 120014-30-4 ]
  • 2-(4-((5,6-dimethoxy-1-oxo-2,3-dihydro-1H-inden-2-yl)methyl)piperidin-1-yl)-N-(p-nitrophenyl)acetamide [ No CAS ]
YieldReaction ConditionsOperation in experiment
93% With potassium carbonate; In acetone; at 40℃; for 12h; General procedure: A mixtureof 5,6-dimethoxy-2-(piperidin-4-yl-methyl)-2,3-dihydro-1Hinden-1-one (1 mmol, 0.289 g) and 2-chloro-N-arylacetamide derivatives(1 mmol) in acetone (10 mL)was stirred at 40 C for 12 h inthe presence of potassium carbonate (1 mmol, 0.138 g). The solventwas evaporated. The residue was washed with water, dried andcrystallized from ethanol [61].
 

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