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CS-W001157 4
Total: USD 88.00

Isophthalic acid

  • CAS No. 121-91-5

  • Cat. No. CS-0020265
  • Purity≥95%
  • MDL No.MFCD00002516

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

Isophthalic acid|CS-0020265

Structure of 121-91-5

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General Information

  • CAS No. 121-91-5
  • Cat. No. CS-0020265
  • Purity ≥95%
  • MDL No. MFCD00002516
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆O₄
  • Molecular Weight None
  • Synonym(s) None
  • SMILES O=C(C1=CC=CC(C(O)=O)=C1)O

Synthesis

  • Route1
    • null|null
      108-38-3
    • ~78%
    • In-stock
      Isophthalic acid|CS-0020265
      121-91-5

    References

    • University of Kansas Patent: US2008/139841 A1, 2008 ; Location in patent: Page/Page column 6 ;
  • Route2

    References

    • Parida, Keshaba Nanda; Jhulki, Samik; Mandal, Susovan; Moorthy, Jarugu Narasimha Tetrahedron, 2012 , vol. 68, # 47 p. 9763 - 9768,6 Title/Abstract Full Text Show Details Parida, Keshaba Nanda; Jhulki, Samik; Mandal, Susovan; Moorthy, Jarugu Narasimha Tetrahedron, 2012 , vol. 68, # 47 p. 9763 - 9768
  • Route3

    References

    • McKillop, Alexander; Kemp, Duncan Tetrahedron, 1989 , vol. 45, # 11 p. 3299 - 3306

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   74.6
  • LogP   1.083
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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