Tel:

Email:

EN
Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

5-Nitroisobenzofuran-1,3-dione

  • CAS No. 5466-84-2

  • Cat. No. CS-W008336
  • Purity≥97%
  • MDL No.None

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

5-Nitroisobenzofuran-1,3-dione|CS-W008336

Structure of 5466-84-2

Please choose your location and provide accurate information for you
Size Stock
Price Quantity

* Please select Quantity before adding items.

General Information

  • CAS No. 5466-84-2
  • Cat. No. CS-W008336
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₃NO₅
  • Molecular Weight 193.11
  • Synonym(s) ethyl {[(3,4-dichlorophenyl)carbamoyl]oxy}methylcarbamate
  • SMILES O=C1OC(C2=C1C=CC([N+]([O-])=O)=C2)=O

Description

5-Nitroisobenzofuran-1,3-dione features a fused bicyclic core with an electron-deficient isobenzofuranquinone scaffold bearing a para-nitro substituent. This configuration imparts enhanced reactivity in cycloaddition processes and facilitates incorporation into complex molecular architectures under mild conditions. The compound exhibits bench-stable handling characteristics and serves as a key building block for bioactive heterocycles and advanced synthetic intermediates.

Application

5-Nitroisobenzofuran-1,3-dione serves as a versatile building block in synthetic organic chemistry, enabling efficient access to functionalized heterocyclic scaffolds. Its electron-deficient furan core facilitates Diels-Alder reactions and nucleophilic additions, while the nitro group enhances reactivity and provides a handle for downstream transformations. The compound exhibits good bench stability and is compatible with common protecting group strategies, making it valuable for iterative synthesis workflows in medicinal chemistry and materials science.

Synthesis

  • Route1
    • 4-Nitrophthalic acid Apremilast Impurity|CS-0173715
      610-27-5
    • ~94%
    • In-stock
      5-Nitroisobenzofuran-1,3-dione|CS-W008336
      5466-84-2

    References

    • D'Alelio; Gaetano F. Patent: US3979416 A1, 1976 ;
  • Route2

    References

    • Leblois, Danielle; Piessard, Sylvie; Baut, Guillaume Le; Kumar, Piyush; Brion, Jean-Daniel; et al. European Journal of Medicinal Chemistry, 1987 , vol. 22, p. 229 - 238
  • Route3
    • null|null
      99-51-4
    • ~%
    • In-stock
      5-Nitroisobenzofuran-1,3-dione|CS-W008336
      5466-84-2

    References

    • Journal of the Chemical Society, , vol. 95, p. 208

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

To search for quality control of cas , please enter both the product number and the lot/batch number.

Computational Chemistry Data

  • TPSA   86.51
  • LogP   0.9054
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   1

Other Classifications

Recently Viewed Products

Leave US a Message
Upload Pictures

Key Words

  • 5-Nitroisobenzofuran-1,3-dione sigma5-Nitroisobenzofuran-1,3-dione manufacturer5-Nitroisobenzofuran-1,3-dione price5-Nitroisobenzofuran-1,3-dione structure5-Nitroisobenzofuran-1,3-dione SDSbuy 5-Nitroisobenzofuran-1,3-dione5-Nitroisobenzofuran-1,3-dione supplier5-Nitroisobenzofuran-1,3-dione uses5-Nitroisobenzofuran-1,3-dione molecular weightprice of 5-Nitroisobenzofuran-1,3-dione5-Nitroisobenzofuran-1,3-dione chemical name formula of 5-Nitroisobenzofuran-1,3-dione
This product is not sold in the region.
Confirm
How to get a Lot Number

Lot numbers can be found on the outside label of a product:

ChemScene Label