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CS-W001157 4
Total: USD 88.00

6-Aminobenzo[de]isochromene-1,3-dione

  • CAS No. 6492-86-0

  • Cat. No. CS-W006543
  • Molecule weightNone
  • Purity≥95%
  • MDL No.MFCD00009776

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

6-Aminobenzo[de]isochromene-1,3-dione|CS-W006543

Structure of 6492-86-0

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General Information

  • CAS No. 6492-86-0
  • Cat. No. CS-W006543
  • Purity ≥95%
  • MDL No. MFCD00009776
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₇NO₃
  • Molecular Weight None
  • Synonym(s) 4-Amino-1,8-naphthalic anhydride
  • SMILES NC1=CC=C2C(=O)OC(=O)C3=C2C1=CC=C3

Description

6-Aminobenzo[de]isochromene-1,3-dione features a fused polycyclic core with dual carbonyl groups and a strategically positioned amine at the 6-position. This electron-rich scaffold enables direct incorporation into bioactive molecule designs, offering enhanced solubility and stability under standard reaction conditions. The functionalized structure supports efficient derivatization in synthetic medicinal chemistry workflows.

Application

6-Aminobenzo[de]isochromene-1,3-dione serves as a versatile scaffold for constructing biologically relevant heterocycles, enabling efficient functionalization at the amino and carbonyl positions. Its inherent stability and compatibility with standard coupling reactions facilitate downstream derivatization in medicinal chemistry workflows. The molecule functions as a key building block for polyheterocyclic systems, particularly in the synthesis of fused ring architectures with documented utility in kinase inhibitor development.

Synthesis

  • Route1

    References

    • Cheon, Kap-Soo; Kazmaier, Peter M.; Keum, Sam-Rok; Park, Kuk-Tae; Buncel, Erwin Canadian Journal of Chemistry, 2004 , vol. 82, # 4 p. 551 - 566
  • Route2

    References

    • US6177423 B1, ;
  • Route3
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    • In-stock
      6-Aminobenzo[de]isochromene-1,3-dione|CS-W006543
      6492-86-0

    References

    • Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, , vol. 41, # 6 p. 1238 - 1245

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS08
Signal Word : Danger
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302+H312+H332-H315-H319-H335-H350
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   69.39
  • LogP   1.7326
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   0

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