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CS-W001157 4
Total: USD 88.00

2-(2,4-Dihydroxybenzoyl)benzoic acid Aspirin Impurity

  • CAS No. 2513-33-9

  • Cat. No. CS-0228744
  • Purity≥98%
  • MDL No.MFCD00433869

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

2-(2,4-Dihydroxybenzoyl)benzoic acid Aspirin  Impurity|CS-0228744

Structure of 2513-33-9

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General Information

  • CAS No. 2513-33-9
  • Cat. No. CS-0228744
  • Purity ≥98%
  • MDL No. MFCD00433869
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₀O₅
  • Molecular Weight 258.23
  • Synonym(s) (2 -(2,4-Dihydroxybenzoyl)) Aspirin IMpurity (2-(2,4-Dihydroxybenzoyl)benzoic Acid)
  • SMILES O=C(C1=CC=CC=C1C(O)=O)C2=C(O)C=C(O)C=C2

Synthesis

  • Route1

    References

    • Inouye, Masahiko; Tsuchiya, Kikuo; Kitao, Teijiro Angewandte Chemie, 1992 , vol. 104, # 2 p. 198 - 200
  • Route2
    • null|null
      1384988-00-4
    • ~88%
    • 2-(2,4-Dihydroxybenzoyl)benzoic acid Aspirin  Impurity|CS-0228744
      2513-33-9

    References

    • Azuma, Eriko; Nakamura, Naoko; Kuramochi, Kouji; Sasamori, Takahiro; Tokitoh, Norihiro; Sagami, Ikuko; Tsubaki, Kazunori Journal of Organic Chemistry, 2012 , vol. 77, # 7 p. 3492 - 3500
  • Route3
    • null|null
      85-44-9
    • null|null
      108-46-3
    • ~88%
    • 2-(2,4-Dihydroxybenzoyl)benzoic acid Aspirin  Impurity|CS-0228744
      2513-33-9

    References

    • Smith, Gerry A.; Metcalfe, James C.; Clarke, Sonia D. Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1993 , # 6 p. 1195 - 1204

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   94.83
  • LogP   2.027
  • H_Acceptors   4
  • H_Donors   3
  • Rotatable_Bonds   3

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