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CS-W001157 4
Total: USD 88.00

5-Nitro-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate

  • CAS No. 14926-29-5

  • Cat. No. CS-0535643
  • Purity≥98%
  • MDL No.None

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

5-Nitro-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate|CS-0535643

Structure of 14926-29-5

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General Information

  • CAS No. 14926-29-5
  • Cat. No. CS-0535643
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₄H₁₅NO₉
  • Molecular Weight 461.38
  • Synonym(s) Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 3',6'-bis(acetyloxy)-5-nitro-
  • SMILES O=C1OC2(C3=C(OC4=C2C=CC(OC(C)=O)=C4)C=C(OC(C)=O)C=C3)C5=C1C=C([N+]([O-])=O)C=C5

Synthesis

  • Route1
    • 4-Nitrophthalic acid Apremilast Impurity|CS-0173715
      610-27-5
    • null|null
      108-24-7
    • null|null
      120-80-9
    • ~28%
    • 5-Nitro-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate|CS-0535643
      14926-29-5
    • 6-Nitro-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate|CS-0535651
      53299-21-1

    References

    • Helvetica Chimica Acta, , vol. 86, # 7 p. 2299 - 2334
  • Route2
    • 4-Nitrophthalic acid Apremilast Impurity|CS-0173715
      610-27-5
    • null|null
      108-24-7
    • null|null
      108-46-3
    • ~%
    • 5-Nitro-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate|CS-0535643
      14926-29-5
    • 6-Nitro-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthene]-3',6'-diyl diacetate|CS-0535651
      53299-21-1

    References

    • ACS Medicinal Chemistry Letters, , vol. 3, # 9 p. 774 - 779

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   131.27
  • LogP   4.0134
  • H_Acceptors   9
  • H_Donors   0
  • Rotatable_Bonds   3

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