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CS-W001157 4
Total: USD 88.00

2,5-Dioxopyrrolidin-1-yl 2-chlorobenzoate

  • CAS No. 68388-08-9

  • Cat. No. CS-0358998
  • Purity≥98%
  • MDL No.None

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

2,5-Dioxopyrrolidin-1-yl 2-chlorobenzoate|CS-0358998

Structure of 68388-08-9

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General Information

  • CAS No. 68388-08-9
  • Cat. No. CS-0358998
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₈ClNO₄
  • Molecular Weight 253.64
  • Synonym(s) 2,5-Pyrrolidinedione, 1-[(2-chlorobenzoyl)oxy]-
  • SMILES C1=CC=C(C(=C1)C(=O)ON2C(=O)CCC2=O)Cl

Synthesis

  • Route1

    References

    • Doughty; Chaurasia; Li Journal of Medicinal Chemistry, 1993 , vol. 36, # 2 p. 272 - 279
  • Route2

    References

    • Wang, Naiwei; Liu, Renhua; Xu, Qing; Liang, Xinmiao Chemistry Letters, 2006 , vol. 35, # 6 p. 566 - 567
  • Route3

    References

    • Tan, Bin; Toda, Narihiro; Barbas III, Carlos F. Angewandte Chemie - International Edition, 2012 , vol. 51, # 50 p. 12538 - 12541 Angew. Chem., 2012 , vol. 124, # 50 p. 12706 - 12709,4

Safety Information

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GHS Pictogram : N/A
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UN#: N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   63.68
  • LogP   1.5608
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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