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CS-W001157 4
Total: USD 88.00

4-(Acetoxymethyl)benzoic acid

  • CAS No. 15561-46-3

  • Cat. No. CS-0148557
  • Molecule weight194.18
  • Purity≥98%
  • MDL No.MFCD01090957

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

4-(Acetoxymethyl)benzoic acid|CS-0148557

Structure of 15561-46-3

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General Information

  • CAS No. 15561-46-3
  • Cat. No. CS-0148557
  • Purity ≥98%
  • MDL No. MFCD01090957
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀O₄
  • Molecular Weight 194.18
  • Synonym(s) 4-Acetoxymethyl-benzoesaeure
  • SMILES O=C(O)C1=CC=C(COC(C)=O)C=C1

Synthesis

  • Route1

    References

    • Pfaff, Dominik; Nemecek, Gregor; Podlech, Joachim Beilstein Journal of Organic Chemistry, 2013 , vol. 9, p. 1572 - 1577
  • Route2

    References

    • Gigante, Federica; Kaiser, Marcel; Brun, Reto; Gilbert, Ian H. Bioorganic and Medicinal Chemistry, 2010 , vol. 18, # 20 p. 7291 - 7301
  • Route3

    References

    • Tashiro, Yasutaka; Iwahama, Takahiro; Sakaguchi, Satoshi; Ishii, Yasutaka Advanced Synthesis and Catalysis, 2001 , vol. 343, # 2 p. 220 - 225

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   63.6
  • LogP   1.4479
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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