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CS-W001157 4
Total: USD 88.00

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

  • CAS No. 106660-11-1

  • Cat. No. CS-0119961
  • Purity≥98%
  • MDL No.MFCD00574012

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

2-(3-Oxo-3,4-dihydro-2H-benzo[b][1,4]oxazin-2-yl)acetic acid|CS-0119961

Structure of 106660-11-1

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General Information

  • CAS No. 106660-11-1
  • Cat. No. CS-0119961
  • Purity ≥98%
  • MDL No. MFCD00574012
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉NO₄
  • Molecular Weight 207.18
  • Synonym(s) (3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl)acetic acid
  • SMILES O=C(O)CC(OC1=CC=CC=C1N2)C2=O

Synthesis

  • Route1
    • 4-((2-Hydroxyphenyl)amino)-4-oxobut-2-enoic acid|CS-1162723
      83549-07-9
    • ~93%
    • In-stock
      2-(3-Oxo-3,4-dihydro-2H-benzo[b][1,4]oxazin-2-yl)acetic acid|CS-0119961
      106660-11-1

    References

    • WO2012/127385 A1, ; Page/Page column 56 ;
  • Route2
    • null|null
      1400984-80-6
    • ~90%
    • In-stock
      2-(3-Oxo-3,4-dihydro-2H-benzo[b][1,4]oxazin-2-yl)acetic acid|CS-0119961
      106660-11-1

    References

    • WO2013/136288 A1, ; Page/Page column 29; 30 ;
  • Route3
    • null|null
      108-31-6
    • null|null
      95-55-6
    • ~98%
    • In-stock
      2-(3-Oxo-3,4-dihydro-2H-benzo[b][1,4]oxazin-2-yl)acetic acid|CS-0119961
      106660-11-1

    References

    • Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), , # 1 p. 159 - 162

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

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Computational Chemistry Data

  • TPSA   75.63
  • LogP   0.8608
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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