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CS-W001157 4
Total: USD 88.00

6-(4-Chloro-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2h)-one

  • CAS No. 117397-88-3

  • Cat. No. CS-0283164
  • Purity95+%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

6-(4-Chloro-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2h)-one|CS-0283164

Structure of 117397-88-3

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General Information

  • CAS No. 117397-88-3
  • Cat. No. CS-0283164
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀ClN₃O₃
  • Molecular Weight 267.67
  • Synonym(s) 6-(4-chloro-3-nitrophenyl)-5-methyl-2,3,4,5-tetrahydropyridazin-3-one
  • SMILES CC1CC(NN=C1C2=CC([N+]([O-])=O)=C(Cl)C=C2)=O

Synthesis

  • Route1
    • 4-(4-Chloro-3-nitrophenyl)-3-methyl-4-oxobutanoic acid|CS-0275744
      85633-96-1
    • ~96%
    • 6-(4-Chloro-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2h)-one|CS-0283164
      117397-88-3

    References

    • Jonas, R; Klockow, M; Lues, I; Pruecher, H; Schliep, H J; Wurziger, H European Journal of Medicinal Chemistry, 1993 , vol. 28, # 2 p. 129 - 140
  • Route2
    • null|null
      53012-96-7
    • ~%
    • 6-(4-Chloro-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2h)-one|CS-0283164
      117397-88-3

    References

    • EUROVET ANIMAL HEALTH B.V. Patent: US2011/152283 A1, 2011 ;
  • Route3

    References

    • EUROVET ANIMAL HEALTH B.V. Patent: US2011/152283 A1, 2011 ;

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   84.6
  • LogP   2.1083
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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