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CS-W001157 4
Total: USD 88.00

2-Oxo-4-phenyl-3-butenoic acid

  • CAS No. 17451-19-3

  • Cat. No. CS-0127078
  • Molecule weight176.17
  • Purity≥98%
  • MDL No.MFCD17676418

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

2-Oxo-4-phenyl-3-butenoic acid|CS-0127078

Structure of 17451-19-3

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General Information

  • CAS No. 17451-19-3
  • Cat. No. CS-0127078
  • Purity ≥98%
  • MDL No. MFCD17676418
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈O₃
  • Molecular Weight 176.17
  • Synonym(s) None
  • SMILES O=C(C(/C=C/C1=CC=CC=C1)=O)O

Synthesis

  • Route1
    • null|null
      100-52-7
    • Pyruvic acid, ≥97%|CS-1268663
      127-17-3
    • ~%
    • 2-Oxo-4-phenyl-3-butenoic acid|CS-0127078
      17451-19-3

    References

    • Erlenmeyer jun. Chemische Berichte, 1903 , vol. 36, p. 2524 Chemische Berichte, 1905 , vol. 38, p. 3126 Full Text Show Details Claisen; Claparede Chemische Berichte, 1881 , vol. 14, p. 2472
  • Route2

    References

    • Claisen; Antweiler Chemische Berichte, 1880 , vol. 13, p. 2124
  • Route3
    • null|null
      506-64-9
    • null|null
      102-92-1
    • ~%
    • 2-Oxo-4-phenyl-3-butenoic acid|CS-0127078
      17451-19-3

    References

    • Claisen; Antweiler Chemische Berichte, 1880 , vol. 13, p. 2124

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   85.87
  • LogP   0.5288
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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