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CS-W001157 4
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3,​4-​Dihydro-​3-​oxo-​2H-​1,​4-​benzoxazine-​5-​carboxylic acid

  • CAS No. 483282-25-3

  • Cat. No. CS-0139154
  • Purity≥97%
  • MDL No.None

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

3,​4-​Dihydro-​3-​oxo-​2H-​1,​4-​benzoxazine-​5-​carboxylic acid|CS-0139154

Structure of 483282-25-3

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General Information

  • CAS No. 483282-25-3
  • Cat. No. CS-0139154
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₄
  • Molecular Weight 193.16
  • Synonym(s) 3-Oxo-3,4-dihydro-2h-benzo[b][1,4]oxazine-5-carboxylic acid
  • SMILES O=C(C1=C(N2)C(OCC2=O)=CC=C1)O

Synthesis

  • Route1
    • Methyl 3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-5-carboxylate|CS-0329872
      1017273-31-2
    • ~%
    • In-stock
      3,​4-​Dihydro-​3-​oxo-​2H-​1,​4-​benzoxazine-​5-​carboxylic acid|CS-0139154
      483282-25-3

    References

    • Ceccarelli, Simona M.; Jaeschke, Georg; Buettelmann, Bernd; Huwyler, Joerg; Kolczewski, Sabine; Peters, Jens-Uwe; Prinssen, Eric; Porter, Richard; Spooren, Will; Vieira, Eric Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 5 p. 1302 - 1306

Safety Information

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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-P280-P302+P352

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Computational Chemistry Data

  • TPSA   75.63
  • LogP   0.7157
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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