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Chemical Structure| 120977-94-8 Chemical Structure| 120977-94-8

Structure of 120977-94-8

Chemical Structure| 120977-94-8

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Product Details of [ 120977-94-8 ]

CAS No. :120977-94-8
Formula : C4H2Cl2N2O
M.W : 164.98
SMILES Code : ClC1=NC(=CC(N1)=O)Cl
MDL No. :MFCD00955562
InChI Key :PVXOAKRQJOOIQX-UHFFFAOYSA-N
Pubchem ID :135452738

Safety of [ 120977-94-8 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H332-H335
Precautionary Statements:P261-P280-P305+P351+P338

Application In Synthesis of [ 120977-94-8 ]

* 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 [ 120977-94-8 ]

[ 120977-94-8 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 120977-94-8 ]
  • [ 171049-35-7 ]
  • 6-((1'-tert-butoxycarbonyl-4,4'-bipiperidin)-1-yl)-2-chloro-3H-pyrimid-4-one [ No CAS ]
YieldReaction ConditionsOperation in experiment
126 mg (52%) In ethanol; Step A 6-((1'-tert-Butoxycarbonyl-4,4'-bipiperidin)-1-yl)-2-chloro-3H-pyrimid-4-one A solution of 100 mg (0.61 mmol) of <strong>[120977-94-8]2,6-dichloropyrimid-4-one</strong> (Helv. Chim. Acta 1989, 72, 738) and 246 mg (0.92 mmol) of 1-tert-butoxycarbonyl-4,4'-bipiperidine in 6 mL of EtOH was refluxed for 2.25 hours. After cooling the reaction with an ice bath, the resulting solid was filtered and dried to yield 126 mg (52%) of the title compound: Rf: 0.77 (90:10:1 v/v/v CH2Cl2/MeOH/NH4OH); 1H NMR (500 MHz, CD3OD) delta 1.12-1.85 (m, 19H), 2.62-2.67 (m, 2H), 2.87-2.92 (m, 2H), 4.13-4.15 (m, 2H), 4.53-4.55 (m, 2H), 5.74 (s, 1H).
 

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