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CS-W001157 4
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Methyl 2-(4-cyano-2-nitrophenoxy)acetate

  • CAS No. 652997-70-1

  • Cat. No. CS-0326727
  • Purity≥97%
  • MDL No.None

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

Methyl 2-(4-cyano-2-nitrophenoxy)acetate|CS-0326727

Structure of 652997-70-1

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General Information

  • CAS No. 652997-70-1
  • Cat. No. CS-0326727
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈N₂O₅
  • Molecular Weight 236.18
  • Synonym(s) Methyl (4-cyano-2-nitrophenoxy)acetate
  • SMILES O=C(OC)COC1=CC=C(C#N)C=C1[N+]([O-])=O

Synthesis

  • Route1

    References

    • Takeda Pharmaceutical Company Limited Patent: EP1541576 A1, 2005 ; Location in patent: Page/Page column 43 ; EP 1541576 A1

Safety Information

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GHS Pictogram : N/A
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UN#: N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   102.46
  • LogP   1.01828
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   4

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