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Methyl 4-cyano-5-methoxy-2-nitrobenzoate

  • CAS No. 1804413-87-3

  • Cat. No. CS-0491100
  • Purity≥98%
  • MDL No.MFCD28779383

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

Methyl 4-cyano-5-methoxy-2-nitrobenzoate|CS-0491100

Structure of 1804413-87-3

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General Information

  • CAS No. 1804413-87-3
  • Cat. No. CS-0491100
  • Purity ≥98%
  • MDL No. MFCD28779383
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈N₂O₅
  • Molecular Weight 236.18
  • Synonym(s) None
  • SMILES COC(=O)C1=C([N+](=O)[O-])C=C(C#N)C(OC)=C1

Safety Information

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Computational Chemistry Data

  • TPSA   102.46
  • LogP   1.26168
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   3

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