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CS-W001157 4
Total: USD 88.00

2-((1,3-Dioxoisoindolin-2-yl)methyl)benzoic acid

  • CAS No. 53663-18-6

  • Cat. No. CS-0498218
  • Purity≥98%
  • MDL No.None

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

2-((1,3-Dioxoisoindolin-2-yl)methyl)benzoic acid|CS-0498218

Structure of 53663-18-6

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General Information

  • CAS No. 53663-18-6
  • Cat. No. CS-0498218
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₁NO₄
  • Molecular Weight 281.26
  • Synonym(s) α-PhthaliMido-o-toluic acid
  • SMILES O=C(O)C1=CC=CC=C1CN(C(C2=C3C=CC=C2)=O)C3=O

Synthesis

  • Route1

    References

    • Niewiadomski, Sven; Beebeejaun, Zeenat; Denton, Helen; Smith, Terry K.; Morris, Richard J.; Wagner, Gerd K. Organic and Biomolecular Chemistry, 2010 , vol. 8, # 15 p. 3488 - 3499
  • Route2
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    • 2-((1,3-Dioxoisoindolin-2-yl)methyl)benzoic acid|CS-0498218
      53663-18-6

    References

    • Bornstein et al. Journal of the American Chemical Society, 1956 , vol. 78, p. 83,85
  • Route3
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      345927-99-3
    • ~%
    • 2-((1,3-Dioxoisoindolin-2-yl)methyl)benzoic acid|CS-0498218
      53663-18-6

    References

    • Bornstein et al. Journal of the American Chemical Society, 1956 , vol. 78, p. 83,85

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H317
Precautionary Statements : P261-P264-P270-P272-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   74.68
  • LogP   2.181
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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