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CS-W001157 4
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2-(3-Oxo-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)acetic acid

  • CAS No. 26494-55-3

  • Cat. No. CS-0037903
  • Purity≥97%
  • MDL No.None

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

2-(3-Oxo-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)acetic acid|CS-0037903

Structure of 26494-55-3

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General Information

  • CAS No. 26494-55-3
  • Cat. No. CS-0037903
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉NO₄
  • Molecular Weight 207.18
  • Synonym(s) 2,3-Dihydro-3-Oxo-4H-1,4-Benzoxazine-4-Acetic Acid
  • SMILES C1=CC2=C(C=C1)OCC(=O)N2CC(=O)O

Synthesis

  • Route1
    • Methyl 2-(3-oxo-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)acetate|CS-0361733
      450358-64-2
    • ~%
    • In-stock
      2-(3-Oxo-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)acetic acid|CS-0037903
      26494-55-3

    References

    • Wu, Lingyun; Lu, Kai; Desai, Mahesh; Packiarajan, Mathivanan; Joshi, Amita; Marzabadi, Mohammad R.; Jubian, Vrej; Andersen, Kim; Chandrasena, Gamini; Boyle, Noel J.; Walker, Mary W. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 18 p. 5573 - 5576
  • Route2
    • In-stock
      2H-1,4-Benzoxazin-3(4H)-one|CS-W002455
      5466-88-6
    • null|null
      79-08-3
    • ~73%
    • In-stock
      2-(3-Oxo-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)acetic acid|CS-0037903
      26494-55-3

    References

    • Huang, Zhi-Zhen; Zu, Liu-Sheng Organic Preparations and Procedures International, 1996 , vol. 28, # 1 p. 121 - 123
  • Route3

    References

    • Wu, Lingyun; Lu, Kai; Desai, Mahesh; Packiarajan, Mathivanan; Joshi, Amita; Marzabadi, Mohammad R.; Jubian, Vrej; Andersen, Kim; Chandrasena, Gamini; Boyle, Noel J.; Walker, Mary W. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 18 p. 5573 - 5576

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   66.84
  • LogP   0.4966
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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