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CS-W001157 4
Total: USD 88.00

Dimethyl 5-aminoisophthalate

  • CAS No. 99-27-4

  • Cat. No. CS-W022631
  • Purity≥98%
  • MDL No.MFCD00008435

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

Dimethyl 5-aminoisophthalate|CS-W022631

Structure of 99-27-4

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General Information

  • CAS No. 99-27-4
  • Cat. No. CS-W022631
  • Purity ≥98%
  • MDL No. MFCD00008435
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO₄
  • Molecular Weight 209.20
  • Synonym(s) Dimethyl,5-aminoisophthalate
  • SMILES O=C(OC)C1=CC(N)=CC(C(OC)=O)=C1

Description

Dimethyl 5-aminoisophthalate features a para-substituted aromatic core with strategically positioned amine and ester functionalities. This bifunctional scaffold integrates readily into polyamide and polyester syntheses, offering enhanced solubility and thermal stability under standard conditions. The amine group enables direct coupling without protection, streamlining access to functionalized polymers and bioconjugates.

Application

Dimethyl 5-aminoisophthalate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted aromatic scaffolds. Its dual ester functionality and ortho-amino group facilitate sequential transformations, including amide formation, reductive amination, and transition-metal-catalyzed coupling reactions. The compound exhibits good bench stability and simplifies purification due to its crystalline nature, making it well-suited for iterative synthesis in medicinal chemistry and materials science applications.

Synthesis

  • Route1

    References

    • Journal of the Chemical Society, , vol. 87, p. 1265
  • Route2

    References

    • Sukul, Pradip K.; Malik, Sudip RSC Advances, 2013 , vol. 3, # 6 p. 1902 - 1915
  • Route3

    References

    • Journal of the Chemical Society, , vol. 87, p. 1265

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

Quality Control

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Computational Chemistry Data

  • TPSA   78.62
  • LogP   0.842
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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