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CS-W001157 4
Total: USD 88.00

5-Chloroisobenzofuran-1,3-dione

  • CAS No. 118-45-6

  • Cat. No. CS-W019466
  • Purity≥98%
  • MDL No.MFCD00152354

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

5-Chloroisobenzofuran-1,3-dione|CS-W019466

Structure of 118-45-6

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General Information

  • CAS No. 118-45-6
  • Cat. No. CS-W019466
  • Purity ≥98%
  • MDL No. MFCD00152354
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₃ClO₃
  • Molecular Weight 182.56
  • Synonym(s) Chlorophtalicanhydre
  • SMILES C1=C(Cl)C=CC2=C1C(OC2=O)=O

Synthesis

  • Route1

    References

    • Verbicky, John W.; Williams, Louella Journal of Organic Chemistry, 1983 , vol. 48, # 15 p. 2465 - 2468
  • Route2

    References

    • US4025505 A1, ;
  • Route3
    • Sodium Hydrogen 4-Chlorophthalate contains isomer and Phthalic Acid|CS-0438332
      56047-23-5
    • ~72%
    • In-stock
      5-Chloroisobenzofuran-1,3-dione|CS-W019466
      118-45-6

    References

    • McClelland, Robert A.; Seaman, N. Esther; Duff, James M.; Branston, R. E. Canadian Journal of Chemistry, 1985 , vol. 63, p. 121 - 128

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   43.37
  • LogP   1.6506
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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