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CS-W001157 4
Total: USD 88.00

3-(4-Bromo-2-fluoro-3-methoxy-phenyl)-3-oxo-propionic acid ethyl ester

  • CAS No. 194804-99-4

  • Cat. No. CS-0340922
  • Purity≥96%
  • MDL No.None

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

3-(4-Bromo-2-fluoro-3-methoxy-phenyl)-3-oxo-propionic acid ethyl ester|CS-0340922

Structure of 194804-99-4

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General Information

  • CAS No. 194804-99-4
  • Cat. No. CS-0340922
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₂BrFO₄
  • Molecular Weight 319.12
  • Synonym(s) Ethyl 3-(4-bromo-2-fluoro-3-methoxyphenyl)-3-oxopropanoate
  • SMILES CCOC(=O)CC(=O)C1=C(C(=C(C=C1)Br)OC)F

Synthesis

  • Route1

    References

    • Wang, Qiuping; Lucien, Edlaine; Hashimoto, Akihiro; Pais, Godwin C. G.; Nelson, David M.; Song, Yongsheng; Thanassi, Jane A.; Marlor, Christopher W.; Thoma, Christy L.; Cheng, Jijun; Podos, Steven D.; Ou, Yangsi; Deshpande, Milind; Pucci, Michael J.; Buechter, Douglas D.; Bradbury, Barton J.; Wiles, Jason A. Journal of Medicinal Chemistry, 2007 , vol. 50, # 2 p. 199 - 210
  • Route2

    References

    • Wang, Qiuping; Lucien, Edlaine; Hashimoto, Akihiro; Pais, Godwin C. G.; Nelson, David M.; Song, Yongsheng; Thanassi, Jane A.; Marlor, Christopher W.; Thoma, Christy L.; Cheng, Jijun; Podos, Steven D.; Ou, Yangsi; Deshpande, Milind; Pucci, Michael J.; Buechter, Douglas D.; Bradbury, Barton J.; Wiles, Jason A. Journal of Medicinal Chemistry, 2007 , vol. 50, # 2 p. 199 - 210
  • Route3

    References

    • Wang, Qiuping; Lucien, Edlaine; Hashimoto, Akihiro; Pais, Godwin C. G.; Nelson, David M.; Song, Yongsheng; Thanassi, Jane A.; Marlor, Christopher W.; Thoma, Christy L.; Cheng, Jijun; Podos, Steven D.; Ou, Yangsi; Deshpande, Milind; Pucci, Michael J.; Buechter, Douglas D.; Bradbury, Barton J.; Wiles, Jason A. Journal of Medicinal Chemistry, 2007 , vol. 50, # 2 p. 199 - 210

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-H320-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   2.7327
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   5

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